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N-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

ChemBase ID: 370533
Molecular Formular: C20H21FN2O4
Molecular Mass: 372.3901432
Monoisotopic Mass: 372.14853538
SMILES and InChIs

SMILES:
C1(=O)N(CC(=O)N(Cc2c(OC)cccc2)Cc2ccc(F)cc2)CCO1
Canonical SMILES:
COc1ccccc1CN(C(=O)CN1CCOC1=O)Cc1ccc(cc1)F
InChI:
InChI=1S/C20H21FN2O4/c1-26-18-5-3-2-4-16(18)13-23(12-15-6-8-17(21)9-7-15)19(24)14-22-10-11-27-20(22)25/h2-9H,10-14H2,1H3
InChIKey:
UPGWRWDJIPWRDA-UHFFFAOYSA-N

Cite this record

CBID:370533 http://www.chembase.cn/molecule-370533.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
N-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
IUPAC Traditional name
N-[(4-fluorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
Synonyms
N-(4-fluorobenzyl)-N-(2-methoxybenzyl)-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem 供应商提供(Chembridge)
Acid pKa 18.293287  H Acceptors
H Donor LogD (pH = 5.5) 2.4171996 
LogD (pH = 7.4) 2.4171996  Log P 2.4171996 
Molar Refractivity 97.5189 cm3 Polarizability 37.41498 Å3
Polar Surface Area 59.08 Å2 Rotatable Bonds
Lipinski's Rule of Five true 
H Acceptors H Donor
Log P 2.62  LOG S -4.15 
Polar Surface Area 59.08 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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