2-amino-1-(2-chlorophenyl)-4-[3-(ethylsulfanyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(2-chlorophenyl)-4-[3-(ethylsulfanyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-1-(2-chlorophenyl)-4-[3-(ethylsulfanyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 4306-0346 |
| Compound Name: | 2-amino-1-(2-chlorophenyl)-4-[3-(ethylsulfanyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 442 |
| Molecular Formula: | C22 H20 Cl N3 O S2 |
| Smiles: | CCSc1ccsc1C1C(C#N)=C(N)N(C2CCCC(C1=2)=O)c1ccccc1[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3782 |
| logD: | 4.3782 |
| logSw: | -4.316 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.094 |
| InChI Key: | OFMGRWKASWUONQ-IBGZPJMESA-N |