NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-[4-(1-ethyl-1H-imidazol-2-yl)piperidin-1-yl]-2-(phenylsulfanyl)ethan-1-one
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IUPAC Traditional name
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1-[4-(1-ethylimidazol-2-yl)piperidin-1-yl]-2-(phenylsulfanyl)ethanone
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Synonyms
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4-(1-ethyl-1H-imidazol-2-yl)-1-[(phenylthio)acetyl]piperidine
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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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18.84804
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H Acceptors
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2
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H Donor
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0
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LogD (pH = 5.5)
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1.5807965
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LogD (pH = 7.4)
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2.232502
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Log P
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2.2633028
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Molar Refractivity
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95.5017 cm3
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Polarizability
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36.753498 Å3
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Polar Surface Area
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38.13 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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2
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H Donor
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0
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Log P
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2.59
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LOG S
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-3.81
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Polar Surface Area
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38.13 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