NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-(thiophen-2-ylmethyl)-2,3-dihydro-1H-isoindole-1,3-dione
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IUPAC Traditional name
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4-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-(thiophen-2-ylmethyl)isoindole-1,3-dione
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Synonyms
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4-[4-(1-azepanylcarbonyl)-1-piperidinyl]-2-(2-thienylmethyl)-1H-isoindole-1,3(2H)-dione
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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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3.6708307
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LogD (pH = 7.4)
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3.670951
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Log P
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3.6709523
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Molar Refractivity
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126.8831 cm3
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Polarizability
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47.229015 Å3
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Polar Surface Area
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60.93 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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3
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H Donor
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0
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Log P
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3.81
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LOG S
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-5.01
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Polar Surface Area
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60.93 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