ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 4296-0731 |
| Compound Name: | ethyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 498 |
| Molecular Formula: | C25 H24 Cl N3 O4 S |
| Smiles: | CCc1ccccc1NC(CSC1=C(C#N)C(C(C(N1)=O)C(=O)OCC)c1ccccc1[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2954 |
| logD: | 4.2012 |
| logSw: | -4.2444 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.178 |
| InChI Key: | NDZKQRONBNXMPU-UHFFFAOYSA-N |