4-(2H-1,3-benzodioxol-5-yl)-1-(3-fluorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile

Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-1-(3-fluorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Available: 50 mg
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mg
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Compound characteristics

Compound ID: 8017-1198
Compound Name: 4-(2H-1,3-benzodioxol-5-yl)-1-(3-fluorophenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Molecular Weight: 481.53
Molecular Formula: C29 H24 F N3 O3
Smiles: CC1(C)CC2=C(C(C(C#N)=C(N2c2cccc(c2)F)n2cccc2)c2ccc3c(c2)OCO3)C(C1)=O
Stereo: RACEMIC MIXTURE
logP: 5.326
logD: 5.326
logSw: -5.4243
Hydrogen bond acceptors count: 5
Polar surface area: 53.669
InChI Key: ATSLKNNTLZMPJF-SANMLTNESA-N
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