NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-(2-methylpropyl)-N-{2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-1,2-oxazole-5-carboxamide
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IUPAC Traditional name
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3-(2-methylpropyl)-N-{2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-1,2-oxazole-5-carboxamide
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Synonyms
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3-isobutyl-N-{2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl}-5-isoxazolecarboxamide
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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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11.448119
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H Acceptors
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6
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H Donor
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1
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LogD (pH = 5.5)
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0.77751535
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LogD (pH = 7.4)
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1.3902056
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Log P
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1.4077624
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Molar Refractivity
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100.8986 cm3
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Polarizability
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37.267494 Å3
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Polar Surface Area
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87.39 Å2
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Rotatable Bonds
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7
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Lipinski's Rule of Five
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true
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H Acceptors
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6
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H Donor
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1
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Log P
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0.9
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LOG S
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-2.58
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Polar Surface Area
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87.39 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