NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-(3,4-difluorobenzoyl)-6-methoxy-1-[(4-methoxyphenyl)methyl]-1,4-diazepan-2-one
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IUPAC Traditional name
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4-(3,4-difluorobenzoyl)-6-methoxy-1-[(4-methoxyphenyl)methyl]-1,4-diazepan-2-one
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Synonyms
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4-(3,4-difluorobenzoyl)-6-methoxy-1-(4-methoxybenzyl)-1,4-diazepan-2-one
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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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18.388618
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H Acceptors
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4
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H Donor
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0
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LogD (pH = 5.5)
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2.0831034
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LogD (pH = 7.4)
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2.0831034
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Log P
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2.0831034
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Molar Refractivity
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102.8833 cm3
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Polarizability
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38.779243 Å3
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Polar Surface Area
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59.08 Å2
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Rotatable Bonds
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5
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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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0
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Log P
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3.36
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LOG S
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-2.17
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Polar Surface Area
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59.08 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