NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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N'-[2-(azepan-1-yl)ethyl]-N-(2,4-dimethylphenyl)-N'-methylpropanediamide
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IUPAC Traditional name
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N'-[2-(azepan-1-yl)ethyl]-N-(2,4-dimethylphenyl)-N'-methylpropanediamide
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Synonyms
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N-(2-azepan-1-ylethyl)-N'-(2,4-dimethylphenyl)-N-methylmalonamide
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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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13.18769
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H Acceptors
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3
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H Donor
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1
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LogD (pH = 5.5)
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-0.1535362
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LogD (pH = 7.4)
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1.4024981
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Log P
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3.0840163
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Molar Refractivity
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103.7252 cm3
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Polarizability
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39.158546 Å3
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Polar Surface Area
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52.65 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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3
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H Donor
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1
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Log P
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3.47
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LOG S
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-4.69
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Polar Surface Area
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52.65 Å2
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Rotatable Bonds
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6
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent