NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-{1-[(4-methylphenyl)methyl]-4-[1-(propan-2-yl)piperidin-4-yl]piperazin-2-yl}ethan-1-ol
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IUPAC Traditional name
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2-[4-(1-isopropylpiperidin-4-yl)-1-[(4-methylphenyl)methyl]piperazin-2-yl]ethanol
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Synonyms
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2-[4-(1-isopropyl-4-piperidinyl)-1-(4-methylbenzyl)-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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15.921743
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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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-3.5680778
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LogD (pH = 7.4)
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-0.6230668
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Log P
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2.5049975
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Molar Refractivity
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111.1384 cm3
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Polarizability
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43.49359 Å3
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Polar Surface Area
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29.95 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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4
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H Donor
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1
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Log P
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3.36
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LOG S
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-1.45
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Polar Surface Area
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29.95 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