NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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6-[(3-methoxyphenyl)methoxy]-1-(2-phenylethyl)-4-(pyridine-3-carbonyl)-1,4-diazepan-2-one
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IUPAC Traditional name
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6-[(3-methoxyphenyl)methoxy]-1-(2-phenylethyl)-4-(pyridine-3-carbonyl)-1,4-diazepan-2-one
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Synonyms
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6-[(3-methoxybenzyl)oxy]-1-(2-phenylethyl)-4-(3-pyridinylcarbonyl)-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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18.432634
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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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LogD (pH = 5.5)
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2.5882692
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LogD (pH = 7.4)
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2.5930994
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Log P
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2.5931613
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Molar Refractivity
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129.6612 cm3
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Polarizability
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49.86975 Å3
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Polar Surface Area
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71.97 Å2
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Rotatable Bonds
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8
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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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0
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Log P
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4.24
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LOG S
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-3.05
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Polar Surface Area
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71.97 Å2
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Rotatable Bonds
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7
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent