NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-[2-(5-fluoro-1H-1,3-benzodiazol-2-yl)pyrrolidin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
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IUPAC Traditional name
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1-[2-(5-fluoro-1H-1,3-benzodiazol-2-yl)pyrrolidin-1-yl]-2-(4-methoxyphenyl)ethanone
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Synonyms
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5-fluoro-2-{1-[(4-methoxyphenyl)acetyl]-2-pyrrolidinyl}-1H-benzimidazole
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
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11.467266
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H Acceptors
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3
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H Donor
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1
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LogD (pH = 5.5)
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2.8288636
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LogD (pH = 7.4)
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2.9364755
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Log P
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2.9380858
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Molar Refractivity
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95.7972 cm3
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Polarizability
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37.929512 Å3
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Polar Surface Area
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58.22 Å2
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Rotatable Bonds
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4
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Lipinski's Rule of Five
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true
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H Acceptors
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3
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H Donor
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1
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Log P
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2.91
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LOG S
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-4.26
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Polar Surface Area
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58.22 Å2
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Rotatable Bonds
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4
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent