NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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N-[1-(2-phenylethyl)-7-[4-(propan-2-yl)piperazine-1-carbonyl]-1H-1,3-benzodiazol-5-yl]methanesulfonamide
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IUPAC Traditional name
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N-[7-(4-isopropylpiperazine-1-carbonyl)-1-(2-phenylethyl)-1,3-benzodiazol-5-yl]methanesulfonamide
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Synonyms
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N-[7-[(4-isopropyl-1-piperazinyl)carbonyl]-1-(2-phenylethyl)-1H-benzimidazol-5-yl]methanesulfonamide
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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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8.2682295
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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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LogD (pH = 5.5)
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-0.3934701
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LogD (pH = 7.4)
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1.3843317
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Log P
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1.4898385
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Molar Refractivity
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130.0053 cm3
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Polarizability
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51.430664 Å3
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Polar Surface Area
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87.54 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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6
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H Donor
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1
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Log P
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3.27
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LOG S
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-3.22
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Polar Surface Area
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87.54 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