NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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N-{[2-(1H-1,2,4-triazol-1-yl)phenyl]methyl}-1H-pyrazole-4-carboxamide
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IUPAC Traditional name
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N-{[2-(1,2,4-triazol-1-yl)phenyl]methyl}-1H-pyrazole-4-carboxamide
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Synonyms
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N-[2-(1H-1,2,4-triazol-1-yl)benzyl]-1H-pyrazole-4-carboxamide
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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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9.009691
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H Acceptors
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4
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H Donor
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2
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LogD (pH = 5.5)
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0.47526848
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LogD (pH = 7.4)
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0.46505663
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Log P
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0.47551814
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Molar Refractivity
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75.8689 cm3
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Polarizability
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27.61483 Å3
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Polar Surface Area
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88.49 Å2
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Rotatable Bonds
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4
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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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2
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Log P
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0.57
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LOG S
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-1.64
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Polar Surface Area
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88.49 Å2
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Rotatable Bonds
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4
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent