NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(4aR,7aS)-1-(2-methoxyethyl)-4-[3-(2-oxopyrrolidin-1-yl)propanoyl]-octahydro-6λ6-thieno[3,4-b]piperazine-6,6-dione
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IUPAC Traditional name
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(4aR,7aS)-1-(2-methoxyethyl)-4-[3-(2-oxopyrrolidin-1-yl)propanoyl]-hexahydro-6λ6-thieno[3,4-b]piperazine-6,6-dione
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Synonyms
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1-{3-[(4aS*,7aR*)-4-(2-methoxyethyl)-6,6-dioxidohexahydrothieno[3,4-b]pyrazin-1(2H)-yl]-3-oxopropyl}pyrrolidin-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)
H Acceptors
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6
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H Donor
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0
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LogD (pH = 5.5)
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-2.5216384
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LogD (pH = 7.4)
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-2.4219244
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Log P
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-2.4204926
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Molar Refractivity
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91.59 cm3
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Polarizability
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36.94389 Å3
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Polar Surface Area
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87.23 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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6
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H Donor
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0
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Log P
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-1.59
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LOG S
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-1.88
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Polar Surface Area
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87.23 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