NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(3aS,6aR)-3-[3-(4-fluorophenyl)propyl]-5-(pyridin-4-yl)-hexahydro-2H-pyrrolo[3,4-d][1,3]oxazol-2-one
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IUPAC Traditional name
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(3aS,6aR)-3-[3-(4-fluorophenyl)propyl]-5-(pyridin-4-yl)-tetrahydropyrrolo[3,4-d][1,3]oxazol-2-one
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Synonyms
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(3aS*,6aR*)-3-[3-(4-fluorophenyl)propyl]-5-(4-pyridinyl)hexahydro-2H-pyrrolo[3,4-d][1,3]oxazol-2-one
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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)
H Acceptors
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3
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H Donor
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0
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LogD (pH = 5.5)
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2.1220896
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LogD (pH = 7.4)
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2.2541037
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Log P
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3.1053364
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Molar Refractivity
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91.831 cm3
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Polarizability
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35.01364 Å3
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Polar Surface Area
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45.67 Å2
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Rotatable Bonds
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5
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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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0
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Log P
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3.1
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LOG S
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-3.75
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Polar Surface Area
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45.67 Å2
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Rotatable Bonds
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5
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent