NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-(1H-imidazol-1-yl)-1-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]butan-1-one
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IUPAC Traditional name
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4-(imidazol-1-yl)-1-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]butan-1-one
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Synonyms
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1-[4-(1H-imidazol-1-yl)butanoyl]-4-(4-pyridinylmethyl)-1,4-diazepane
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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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4
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H Donor
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0
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LogD (pH = 5.5)
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-2.436015
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LogD (pH = 7.4)
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-0.3142505
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Log P
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0.13639863
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Molar Refractivity
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94.4353 cm3
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Polarizability
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36.255035 Å3
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Polar Surface Area
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54.26 Å2
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Rotatable Bonds
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6
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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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0.1
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LOG S
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-1.68
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Polar Surface Area
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54.26 Å2
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Rotatable Bonds
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6
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent