NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-(3-{2-[(4-fluorophenyl)methyl]-5-oxopyrrolidin-2-yl}propanoyl)-1-[(4-methylphenyl)methyl]piperazin-2-one
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IUPAC Traditional name
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4-(3-{2-[(4-fluorophenyl)methyl]-5-oxopyrrolidin-2-yl}propanoyl)-1-[(4-methylphenyl)methyl]piperazin-2-one
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Synonyms
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4-{3-[2-(4-fluorobenzyl)-5-oxo-2-pyrrolidinyl]propanoyl}-1-(4-methylbenzyl)-2-piperazinone
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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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13.568962
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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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2.3885918
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LogD (pH = 7.4)
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2.3885915
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Log P
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2.388592
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Molar Refractivity
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123.9413 cm3
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Polarizability
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47.464077 Å3
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Polar Surface Area
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69.72 Å2
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Rotatable Bonds
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7
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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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3.83
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LOG S
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-2.92
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Polar Surface Area
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69.72 Å2
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Rotatable Bonds
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7
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent