NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-[1-(difluoromethyl)-1H-pyrazole-5-carbonyl]-N,N-dimethylazepan-4-amine
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IUPAC Traditional name
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1-[2-(difluoromethyl)pyrazole-3-carbonyl]-N,N-dimethylazepan-4-amine
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Synonyms
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1-{[1-(difluoromethyl)-1H-pyrazol-5-yl]carbonyl}-N,N-dimethyl-4-azepanamine
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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)
H Acceptors
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3
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H Donor
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0
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LogD (pH = 5.5)
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-2.346748
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LogD (pH = 7.4)
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-1.2748449
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Log P
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1.0900265
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Molar Refractivity
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83.8153 cm3
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Polarizability
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26.886755 Å3
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Polar Surface Area
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41.37 Å2
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Rotatable Bonds
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3
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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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0
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Log P
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-0.71
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LOG S
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-1.99
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Polar Surface Area
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41.37 Å2
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Rotatable Bonds
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3
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent