methyl 5-cyano-4-(2,4-dichlorophenyl)-6-(methylsulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
methyl 5-cyano-4-(2,4-dichlorophenyl)-6-(methylsulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
methyl 5-cyano-4-(2,4-dichlorophenyl)-6-(methylsulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 3331-3827 |
| Compound Name: | methyl 5-cyano-4-(2,4-dichlorophenyl)-6-(methylsulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 371.24 |
| Molecular Formula: | C15 H12 Cl2 N2 O3 S |
| Smiles: | COC(C1C(C(C#N)=C(NC1=O)SC)c1ccc(cc1[Cl])[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3552 |
| logD: | 3.124 |
| logSw: | -3.7313 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.418 |
| InChI Key: | JXZUVPQUDLTWGP-UHFFFAOYSA-N |