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2-(4-fluorophenyl)-N,N-dimethylpiperidine-1-sulfonamide

ChemBase ID: 410173
Molecular Formular: C13H19FN2O2S
Molecular Mass: 286.3655632
Monoisotopic Mass: 286.11512708
SMILES and InChIs

SMILES:
S(=O)(=O)(N1C(c2ccc(cc2)F)CCCC1)N(C)C
Canonical SMILES:
Fc1ccc(cc1)C1CCCCN1S(=O)(=O)N(C)C
InChI:
InChI=1S/C13H19FN2O2S/c1-15(2)19(17,18)16-10-4-3-5-13(16)11-6-8-12(14)9-7-11/h6-9,13H,3-5,10H2,1-2H3
InChIKey:
DZTNQHJBNFNALJ-UHFFFAOYSA-N

Cite this record

CBID:410173 http://www.chembase.cn/molecule-410173.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-(4-fluorophenyl)-N,N-dimethylpiperidine-1-sulfonamide
IUPAC Traditional name
2-(4-fluorophenyl)-N,N-dimethylpiperidine-1-sulfonamide
Synonyms
2-(4-fluorophenyl)-N,N-dimethyl-1-piperidinesulfonamide

DATA SOURCES

DATA SOURCES

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Data Source Data ID
ChemBridge 24363908 external link Add to cart
Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem 供应商提供(Chembridge)
H Acceptors H Donor
LogD (pH = 5.5) 1.6807073  LogD (pH = 7.4) 1.6807085 
Log P 1.6807086  Molar Refractivity 73.0696 cm3
Polarizability 29.016975 Å3 Polar Surface Area 40.62 Å2
Rotatable Bonds Lipinski's Rule of Five true 
H Acceptors H Donor
Log P 1.18  LOG S -2.3 
Polar Surface Area 40.62 Å2 Rotatable Bonds

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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