NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-[5-(2,6-dimethylphenoxymethyl)-1,2-oxazole-3-carbonyl]-4-[(2-fluorophenyl)methyl]-1,4-diazepane
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IUPAC Traditional name
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1-[5-(2,6-dimethylphenoxymethyl)-1,2-oxazole-3-carbonyl]-4-[(2-fluorophenyl)methyl]-1,4-diazepane
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Synonyms
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1-({5-[(2,6-dimethylphenoxy)methyl]-3-isoxazolyl}carbonyl)-4-(2-fluorobenzyl)-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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3.029202
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LogD (pH = 7.4)
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4.2200656
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Log P
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4.309534
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Molar Refractivity
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122.78 cm3
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Polarizability
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45.901524 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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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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4.22
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LOG S
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-4.54
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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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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent