NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-(4-{[1-(3-chlorophenyl)-1H-pyrazol-4-yl]methyl}-1-(propan-2-yl)piperazin-2-yl)ethan-1-ol
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IUPAC Traditional name
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2-(4-{[1-(3-chlorophenyl)pyrazol-4-yl]methyl}-1-isopropylpiperazin-2-yl)ethanol
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Synonyms
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2-(4-{[1-(3-chlorophenyl)-1H-pyrazol-4-yl]methyl}-1-isopropyl-2-piperazinyl)ethanol
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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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15.921745
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H Acceptors
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4
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H Donor
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1
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LogD (pH = 5.5)
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-0.3462589
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LogD (pH = 7.4)
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1.3694279
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Log P
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2.654633
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Molar Refractivity
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103.8126 cm3
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Polarizability
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40.62555 Å3
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Polar Surface Area
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44.53 Å2
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Rotatable Bonds
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6
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Lipinski's Rule of Five
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true
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H Acceptors
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5
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H Donor
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1
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Log P
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3.89
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LOG S
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-2.55
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Polar Surface Area
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44.53 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