NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-{[2-(furan-2-yl)phenyl]methyl}-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one
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IUPAC Traditional name
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4-{[2-(furan-2-yl)phenyl]methyl}-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one
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Synonyms
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4-[2-(2-furyl)benzyl]-6-methoxy-1-(3-pyridinylmethyl)-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)
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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LogD (pH = 5.5)
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0.5135753
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LogD (pH = 7.4)
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1.9356313
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Log P
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2.0885746
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Molar Refractivity
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111.0284 cm3
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Polarizability
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44.271255 Å3
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Polar Surface Area
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58.81 Å2
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Rotatable Bonds
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6
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H Acceptors
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5
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H Donor
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0
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Log P
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3.51
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LOG S
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-0.91
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Polar Surface Area
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58.81 Å2
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Rotatable Bonds
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5
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent