NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-[2-({1,6-dimethyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}amino)ethyl]-1,3-oxazinan-2-one
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IUPAC Traditional name
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3-[2-({1,6-dimethylpyrazolo[3,4-d]pyrimidin-4-yl}amino)ethyl]-1,3-oxazinan-2-one
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Synonyms
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3-{2-[(1,6-dimethyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl}-1,3-oxazinan-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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18.658834
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H Acceptors
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5
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H Donor
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1
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LogD (pH = 5.5)
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0.35010588
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LogD (pH = 7.4)
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0.35041028
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Log P
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0.3504142
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Molar Refractivity
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89.848 cm3
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Polarizability
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29.132866 Å3
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Polar Surface Area
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85.17 Å2
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Rotatable Bonds
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4
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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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1
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Log P
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0.09
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LOG S
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-2.44
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Polar Surface Area
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85.17 Å2
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Rotatable Bonds
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4
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent