NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-[(6-chloro-4-oxo-4H-chromen-3-yl)methyl]-6-methyl-1-(2-methylphenyl)piperazin-2-one
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IUPAC Traditional name
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4-[(6-chloro-4-oxochromen-3-yl)methyl]-6-methyl-1-(2-methylphenyl)piperazin-2-one
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Synonyms
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4-[(6-chloro-4-oxo-4H-chromen-3-yl)methyl]-6-methyl-1-(2-methylphenyl)-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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17.508709
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H Acceptors
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4
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H Donor
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0
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LogD (pH = 5.5)
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3.5564377
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LogD (pH = 7.4)
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3.630838
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Log P
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3.6318738
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Molar Refractivity
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108.9203 cm3
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Polarizability
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41.877026 Å3
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Polar Surface Area
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49.85 Å2
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Rotatable Bonds
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3
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Lipinski's Rule of Five
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true
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H Acceptors
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4
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H Donor
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0
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Log P
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4.64
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LOG S
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-3.35
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Polar Surface Area
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53.76 Å2
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Rotatable Bonds
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3
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent