Chembase list of 866358 unique molecular structures

3-amino-N-[4-(trifluoromethoxy)phenyl]-1-benzofuran-2-carboxamide

$$$$ Data

M. F.

C16H11F3N2O3

Suppliers	Catalog Number
Life Chemicals	F2147-0591

Database	Data ID
PubChem	33679197

M. W.

336.2653496

CAS

Similarity

N/A

ID: 116802

8-oxa-3,5-diazatricyclo[7.4.0.0²,⁷]trideca-1(13),2(7),3,9,...

$$$$ Data

M. F.

C10H6N2OS

Suppliers	Catalog Number
Life Chemicals	F2147-0592

Database	Data ID
PubChem	3131839

M. W.

202.23244

CAS

Similarity

N/A

ID: 116803

1-(4-fluorophenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C9H7FN2S

Suppliers	Catalog Number
Life Chemicals	F2147-0593

Database	Data ID
PubChem	2737475

M. W.

194.2286832

CAS

Similarity

N/A

ID: 116804

1-(4-bromophenyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine

$$$$ Data

M. F.

C13H13BrN2

Suppliers	Catalog Number
Life Chemicals	F2147-0594

Database	Data ID
PubChem	44116798

M. W.

277.15972

CAS

Similarity

N/A

ID: 116805

5-(4-methoxyphenyl)-1-(3-methylphenyl)-1H-imidazole-2-thiol

$$$$ Data

M. F.

C17H16N2OS

Suppliers	Catalog Number
Life Chemicals	F2147-0595

Database	Data ID
PubChem	33679209

M. W.

296.38674

CAS

Similarity

N/A

ID: 116806

2-oxo-1,2-dihydro-1,8-naphthyridine-3-carboxylic acid

$$$$ Data

M. F.

C9H6N2O3

Suppliers	Catalog Number
Life Chemicals	F2147-0597
Bide Pharmatech	BD28910
A&J Pharmtech	AJA-O31584

Database	Data ID
PubChem	17750172

M. W.

190.15554

CAS

5175-14-4

Similarity

N/A

ID: 116807

ethyl 2-chloro-1,8-naphthyridine-3-carboxylate

$$$$ Data

M. F.

C11H9ClN2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0598
A&J Pharmtech	AJA-O17553

Database	Data ID
PubChem	15067503

M. W.

236.65436

CAS

Similarity

N/A

ID: 116808

5-(2-bromophenyl)imidazolidine-2,4-dione

$$$$ Data

M. F.

C9H7BrN2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0600

Database	Data ID
PubChem	45496509

M. W.

255.06808

CAS

Similarity

N/A

ID: 116809

5-(3-bromophenyl)imidazolidine-2,4-dione

$$$$ Data

M. F.

C9H7BrN2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0601
Enamine	EN300-21919

Database	Data ID
PubChem	45496510

M. W.

255.06808

CAS

Similarity

N/A

ID: 116810

5-(4-bromophenyl)imidazolidine-2,4-dione

$$$$ Data

M. F.

C9H7BrN2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0602

Database	Data ID
PubChem	2978507

M. W.

255.06808

CAS

Similarity

N/A

ID: 116811

5-(5-bromo-2-methoxyphenyl)imidazolidine-2,4-dione

$$$$ Data

M. F.

C10H9BrN2O3

Suppliers	Catalog Number
Life Chemicals	F2147-0603
Enamine	EN300-95961

Database	Data ID
PubChem	45496511

M. W.

285.09406

CAS

Similarity

N/A

ID: 116812

2-amino-2-(2-bromophenyl)acetic acid

$$$$ Data

M. F.

C8H8BrNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0604
Enamine	EN300-53914
A&J Pharmtech	AJA-O34100

Database	Data ID
PubChem	4561836

M. W.

230.05862

CAS

254762-66-8

Similarity

N/A

ID: 116813

2-amino-2-(5-bromo-2-methoxyphenyl)acetic acid

$$$$ Data

M. F.

C9H10BrNO3

Suppliers	Catalog Number
Life Chemicals	F2147-0607
Enamine	EN300-102574

Database	Data ID
PubChem	4553155

M. W.

260.0846

CAS

Similarity

N/A

ID: 116814

methyl 2-amino-2-(2-bromophenyl)acetate

$$$$ Data

M. F.

C9H10BrNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0608

Database	Data ID
PubChem	17998890

M. W.

244.0852

CAS

Similarity

N/A

ID: 116815

methyl 2-amino-2-(3-bromophenyl)acetate

$$$$ Data

M. F.

C9H10BrNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0609

Database	Data ID
PubChem	45159000

M. W.

244.0852

CAS

Similarity

N/A

ID: 116816

methyl 2-amino-2-(4-bromophenyl)acetate

$$$$ Data

M. F.

C9H10BrNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0610

Database	Data ID
PubChem	2764323

M. W.

244.0852

CAS

Similarity

N/A

ID: 116817

methyl 2-amino-2-(5-bromo-2-methoxyphenyl)acetate

$$$$ Data

M. F.

C10H12BrNO3

Suppliers	Catalog Number
Life Chemicals	F2147-0611

Database	Data ID
PubChem	45496512

M. W.

274.11118

CAS

Similarity

N/A

ID: 116818

2-(3-bromophenyl)-2-{[(tert-butoxy)carbonyl]amino}acetic acid

$$$$ Data

M. F.

C13H16BrNO4

Suppliers	Catalog Number
Life Chemicals	F2147-0613

Database	Data ID
PubChem	20823784

M. W.

330.17444

CAS

Similarity

N/A

ID: 116819

2-(4-bromophenyl)-2-{[(tert-butoxy)carbonyl]amino}acetic acid

$$$$ Data

M. F.

C13H16BrNO4

Suppliers	Catalog Number
Life Chemicals	F2147-0614

Database	Data ID
PubChem	22309170

M. W.

330.17444

CAS

917925-71-4

Similarity

N/A

ID: 116820

2-(5-bromo-2-methoxyphenyl)-2-{[(tert-butoxy)carbonyl]amino}acetic acid

$$$$ Data

M. F.

C14H18BrNO5

Suppliers	Catalog Number
Life Chemicals	F2147-0615

Database	Data ID
PubChem	45496513

M. W.

360.20042

CAS

Similarity

N/A

ID: 116821

2-(cyclopentylsulfanyl)acetic acid

$$$$ Data

M. F.

C7H12O2S

Suppliers	Catalog Number
Life Chemicals	F2147-0620
Enamine	EN300-22748

Database	Data ID
PubChem	15728315

M. W.

160.23398

CAS

52363-14-1

Similarity

N/A

ID: 116822

methyl 2-amino-2-(2-fluorophenyl)acetate

$$$$ Data

M. F.

C9H10FNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0629

Database	Data ID
PubChem	45496514

M. W.

183.1796032

CAS

Similarity

N/A

ID: 116823

methyl 2-amino-2-(3-fluorophenyl)acetate

$$$$ Data

M. F.

C9H10FNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0630

Database	Data ID
PubChem	22492174

M. W.

183.1796032

CAS

Similarity

N/A

ID: 116824

methyl 2-amino-2-(2-chlorophenyl)acetate

$$$$ Data

M. F.

C9H10ClNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0632

Database	Data ID
PubChem	11571972

M. W.

199.6342

CAS

Similarity

N/A

ID: 116825

methyl 2-amino-2-(3-chlorophenyl)acetate

$$$$ Data

M. F.

C9H10ClNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0633

Database	Data ID
PubChem	45496515

M. W.

199.6342

CAS

Similarity

N/A

ID: 116826

methyl 2-amino-2-(4-chlorophenyl)acetate

$$$$ Data

M. F.

C9H10ClNO2

Suppliers	Catalog Number
Life Chemicals	F2147-0634
Bide Pharmatech	BD113926

Database	Data ID
PubChem	2763700

M. W.

199.6342

CAS

43189-20-4

Similarity

N/A

ID: 116827

methyl 2-amino-2-(2-methylphenyl)acetate

$$$$ Data

M. F.

C10H13NO2

Suppliers	Catalog Number
Life Chemicals	F2147-0635

Database	Data ID
PubChem	15337750

M. W.

179.21572

CAS

Similarity

N/A

ID: 116828

methyl 2-amino-2-(3-methylphenyl)acetate

$$$$ Data

M. F.

C10H13NO2

Suppliers	Catalog Number
ChemBridge	4050121
Life Chemicals	F2147-0636

Database	Data ID
PubChem	45496516

M. W.

179.21572

CAS

Similarity

N/A

ID: 116829

methyl 2-amino-2-(4-methylphenyl)acetate

$$$$ Data

M. F.

C10H13NO2

Suppliers	Catalog Number
Life Chemicals	F2147-0637
Enamine	EN300-96400

Database	Data ID
PubChem	4357196

M. W.

179.21572

CAS

Similarity

N/A

ID: 116830

methyl 2-amino-2-(2-methoxyphenyl)acetate

$$$$ Data

M. F.

C10H13NO3

Suppliers	Catalog Number
Life Chemicals	F2147-0638

Database	Data ID
PubChem	3977101

M. W.

195.21512

CAS

Similarity

N/A

ID: 116831

methyl 2-amino-2-(3-methoxyphenyl)acetate

$$$$ Data

M. F.

C10H13NO3

Suppliers	Catalog Number
Life Chemicals	F2147-0639

Database	Data ID
PubChem	3367359

M. W.

195.21512

CAS

Similarity

N/A

ID: 116832

methyl 2-amino-2-(4-methoxyphenyl)acetate

$$$$ Data

M. F.

C10H13NO3

Suppliers	Catalog Number
Life Chemicals	F2147-0640
Enamine	EN300-69483

Database	Data ID
PubChem	13617480

M. W.

195.21512

CAS

Similarity

N/A

ID: 116833

methyl 2-amino-2-(naphthalen-2-yl)acetate

$$$$ Data

M. F.

C13H13NO2

Suppliers	Catalog Number
Life Chemicals	F2147-0641

Database	Data ID
PubChem	3507541

M. W.

215.24782

CAS

Similarity

N/A

ID: 116834

methyl 2-amino-2-(naphthalen-1-yl)acetate

$$$$ Data

M. F.

C13H13NO2

Suppliers	Catalog Number
Life Chemicals	F2147-0642

Database	Data ID
PubChem	4019811

M. W.

215.24782

CAS

Similarity

N/A

ID: 116835

methyl 2-amino-3-phenylpropanoate

$$$$ Data

M. F.

C10H13NO2

Suppliers	Catalog Number
Life Chemicals	F2147-0643
A&J Pharmtech	AJA-O38684

Database	Data ID
PubChem	75737

M. W.

179.21572

CAS

2577-90-4

Similarity

N/A

ID: 116836

2-amino-2-(2-methoxyphenyl)acetic acid

$$$$ Data More

M. F.

C9H11NO3

Suppliers	Catalog Number
Life Chemicals	F2147-0647
Enamine	EN300-70393
Bide Pharmatech	BD113895

Database	Data ID
PubChem	2772349

M. W.

181.18854

CAS

103889-84-5

Similarity

N/A

ID: 116837

2-amino-2-(naphthalen-1-yl)acetic acid

$$$$ Data

M. F.

C12H11NO2

Suppliers	Catalog Number
Life Chemicals	F2147-0648

Database	Data ID
PubChem	2772352

M. W.

201.22124

CAS

97611-60-4

Similarity

N/A

ID: 116838

5-(4-fluorophenyl)imidazolidine-2,4-dione

$$$$ Data

M. F.

C9H7FN2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0649

Database	Data ID
PubChem	265439

M. W.

194.1624832

CAS

Similarity

N/A

ID: 116839

5-(4-chlorophenyl)imidazolidine-2,4-dione

$$$$ Data

M. F.

C9H7ClN2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0650

Database	Data ID
PubChem	97124

M. W.

210.61708

CAS

Similarity

N/A

ID: 116840

5-(3-methylphenyl)imidazolidine-2,4-dione

$$$$ Data

M. F.

C10H10N2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0651

Database	Data ID
PubChem	16789942

M. W.

190.1986

CAS

Similarity

N/A

ID: 116841

5-(4-methylphenyl)imidazolidine-2,4-dione

$$$$ Data

M. F.

C10H10N2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0652

Database	Data ID
PubChem	12901637

M. W.

190.1986

CAS

Similarity

N/A

ID: 116842

5-(1-benzothiophen-3-yl)imidazolidine-2,4-dione

$$$$ Data

M. F.

C11H8N2O2S

Suppliers	Catalog Number
Life Chemicals	F2147-0653

Database	Data ID
PubChem	45496517

M. W.

232.25842

CAS

Similarity

N/A

ID: 116843

2-(carbamoylamino)-2-(pyridin-4-yl)acetamide

$$$$ Data

M. F.

C8H10N4O2

Suppliers	Catalog Number
Life Chemicals	F2147-0654

Database	Data ID
PubChem	45496518

M. W.

194.1906

CAS

Similarity

N/A

ID: 116844

1-methyl-3-phenylpiperazine-2,5-dione

$$$$ Data

M. F.

C11H12N2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0655

Database	Data ID
PubChem	16069192

M. W.

204.22518

CAS

Similarity

N/A

ID: 116845

1-ethyl-3-phenylpiperazine-2,5-dione

$$$$ Data

M. F.

C12H14N2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0656

Database	Data ID
PubChem	14833682

M. W.

218.25176

CAS

Similarity

N/A

ID: 116846

3-phenyl-1-propylpiperazine-2,5-dione

$$$$ Data

M. F.

C13H16N2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0657

Database	Data ID
PubChem	45496519

M. W.

232.27834

CAS

Similarity

N/A

ID: 116847

1-methyl-3-(pyridin-3-yl)piperazine-2,5-dione

$$$$ Data

M. F.

C10H11N3O2

Suppliers	Catalog Number
Life Chemicals	F2147-0658

Database	Data ID
PubChem	45496520

M. W.

205.21324

CAS

Similarity

N/A

ID: 116848

1-methyl-3-(naphthalen-1-yl)piperazine-2,5-dione

$$$$ Data

M. F.

C15H14N2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0659

Database	Data ID
PubChem	45496521

M. W.

254.28386

CAS

Similarity

N/A

ID: 116849

1-methyl-3-(naphthalen-2-yl)piperazine-2,5-dione

$$$$ Data

M. F.

C15H14N2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0660

Database	Data ID
PubChem	45496522

M. W.

254.28386

CAS

Similarity

N/A

ID: 116850

3-(2-fluorophenyl)-1-methylpiperazine-2,5-dione

$$$$ Data

M. F.

C11H11FN2O2

Suppliers	Catalog Number
Life Chemicals	F2147-0661

Database	Data ID
PubChem	45496523

M. W.

222.2156432

CAS

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified