ethyl 6-[(2-anilino-2-oxoethyl)sulfanyl]-4-(2-chlorophenyl)-5-cyano-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 6-[(2-anilino-2-oxoethyl)sulfanyl]-4-(2-chlorophenyl)-5-cyano-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
ethyl 6-[(2-anilino-2-oxoethyl)sulfanyl]-4-(2-chlorophenyl)-5-cyano-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 4296-0691 |
| Compound Name: | ethyl 6-[(2-anilino-2-oxoethyl)sulfanyl]-4-(2-chlorophenyl)-5-cyano-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 469.95 |
| Molecular Formula: | C23 H20 Cl N3 O4 S |
| Smiles: | CCOC(C1C(C(C#N)=C(NC1=O)SCC(Nc1ccccc1)=O)c1ccccc1[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6041 |
| logD: | 3.5099 |
| logSw: | -3.7807 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.875 |
| InChI Key: | XHMBNPWOWMWRPZ-UHFFFAOYSA-N |