4-(2,4-dichlorophenyl)-6-oxo-2-[(prop-2-en-1-yl)sulfanyl]-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
4-(2,4-dichlorophenyl)-6-oxo-2-[(prop-2-en-1-yl)sulfanyl]-1,4,5,6-tetrahydropyridine-3-carbonitrile
4-(2,4-dichlorophenyl)-6-oxo-2-[(prop-2-en-1-yl)sulfanyl]-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 2188-1919 |
| Compound Name: | 4-(2,4-dichlorophenyl)-6-oxo-2-[(prop-2-en-1-yl)sulfanyl]-1,4,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 339.24 |
| Molecular Formula: | C15 H12 Cl2 N2 O S |
| Smiles: | C=CCSC1=C(C#N)C(CC(N1)=O)c1ccc(cc1[Cl])[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2081 |
| logD: | 4.16 |
| logSw: | -4.4153 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.187 |
| InChI Key: | KACMZCRXMTUSFK-NSHDSACASA-N |