NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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N-(3,4-dihydro-2H-1-benzopyran-3-ylmethyl)-1-methyl-3-(trimethyl-1H-pyrazol-4-yl)-1H-pyrazole-5-carboxamide
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IUPAC Traditional name
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N-(3,4-dihydro-2H-1-benzopyran-3-ylmethyl)-2-methyl-5-(trimethylpyrazol-4-yl)pyrazole-3-carboxamide
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Synonyms
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N-(3,4-dihydro-2H-chromen-3-ylmethyl)-1,1',3',5'-tetramethyl-1H,1'H-3,4'-bipyrazole-5-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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14.6482725
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H Acceptors
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4
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H Donor
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1
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LogD (pH = 5.5)
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1.9747238
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LogD (pH = 7.4)
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1.9757373
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Log P
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1.9757503
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Molar Refractivity
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130.6948 cm3
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Polarizability
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41.6936 Å3
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Polar Surface Area
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73.97 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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1
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Log P
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1.93
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LOG S
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-3.62
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Polar Surface Area
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73.97 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