NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-(4-chlorophenoxy)-1-[(3R,4R)-3-cyclopropyl-3-hydroxy-4-methylpyrrolidin-1-yl]ethan-1-one
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IUPAC Traditional name
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2-(4-chlorophenoxy)-1-[(3R,4R)-3-cyclopropyl-3-hydroxy-4-methylpyrrolidin-1-yl]ethanone
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Synonyms
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(3R*,4R*)-1-[(4-chlorophenoxy)acetyl]-3-cyclopropyl-4-methylpyrrolidin-3-ol
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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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13.933284
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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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1.9797815
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LogD (pH = 7.4)
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1.9797813
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Log P
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1.9797815
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Molar Refractivity
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80.1331 cm3
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Polarizability
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31.68209 Å3
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Polar Surface Area
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49.77 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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2.03
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LOG S
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-3.19
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Polar Surface Area
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49.77 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