NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-[(4-methoxy-2,3-dimethylphenyl)methyl]-3',4'-dihydro-1'H-spiro[piperidine-4,2'-quinoxaline]-3'-one
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IUPAC Traditional name
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1-[(4-methoxy-2,3-dimethylphenyl)methyl]-1',4'-dihydrospiro[piperidine-4,2'-quinoxaline]-3'-one
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Synonyms
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1-(4-methoxy-2,3-dimethylbenzyl)-1',4'-dihydro-3'H-spiro[piperidine-4,2'-quinoxalin]-3'-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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12.973767
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H Acceptors
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4
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H Donor
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2
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LogD (pH = 5.5)
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0.2691984
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LogD (pH = 7.4)
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1.9970714
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Log P
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3.2336612
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Molar Refractivity
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111.2048 cm3
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Polarizability
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41.265877 Å3
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Polar Surface Area
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53.6 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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3
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H Donor
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2
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Log P
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3.57
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LOG S
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-4.91
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Polar Surface Area
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53.6 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