NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-{[6-(4-chlorophenyl)-2H-[1,3]dioxolo[4,5-g]quinolin-7-yl]methyl}-1,4-diazepan-5-one
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IUPAC Traditional name
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1-{[6-(4-chlorophenyl)-2H-[1,3]dioxolo[4,5-g]quinolin-7-yl]methyl}-1,4-diazepan-5-one
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Synonyms
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1-{[6-(4-chlorophenyl)[1,3]dioxolo[4,5-g]quinolin-7-yl]methyl}-1,4-diazepan-5-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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14.1220455
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H Acceptors
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5
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H Donor
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1
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LogD (pH = 5.5)
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0.46358848
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LogD (pH = 7.4)
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2.2236311
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Log P
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3.2928557
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Molar Refractivity
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109.3918 cm3
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Polarizability
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45.26634 Å3
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Polar Surface Area
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63.69 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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5
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H Donor
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1
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Log P
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2.55
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LOG S
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-4.37
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Polar Surface Area
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63.69 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