4-(2,3-dichlorophenyl)-2-(ethylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
4-(2,3-dichlorophenyl)-2-(ethylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
4-(2,3-dichlorophenyl)-2-(ethylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 3331-4198 |
| Compound Name: | 4-(2,3-dichlorophenyl)-2-(ethylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 327.23 |
| Molecular Formula: | C14 H12 Cl2 N2 O S |
| Smiles: | CCSC1=C(C#N)C(CC(N1)=O)c1cccc(c1[Cl])[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7809 |
| logD: | 3.7407 |
| logSw: | -4.2356 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.187 |
| InChI Key: | HTKJWQJDQULHSN-VIFPVBQESA-N |