2-(benzylsulfanyl)-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile

Chemical Structure Depiction of
2-(benzylsulfanyl)-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Available: 5 mg
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mg
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Compound characteristics

Compound ID: 4552-4055
Compound Name: 2-(benzylsulfanyl)-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Molecular Weight: 418.51
Molecular Formula: C24 H22 N2 O3 S
Smiles: COc1cc(ccc1O)C1C(C#N)=C(NC2CCCC(C1=2)=O)SCc1ccccc1
Stereo: RACEMIC MIXTURE
logP: 3.5334
logD: 1.018
logSw: -3.7335
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 2
Polar surface area: 64.576
InChI Key: WHPCBRKNLAPQOY-QFIPXVFZSA-N
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