methyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
methyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
methyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 4552-5729 |
| Compound Name: | methyl 4-(2-chlorophenyl)-5-cyano-6-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 499.97 |
| Molecular Formula: | C24 H22 Cl N3 O5 S |
| Smiles: | CCOc1ccc(cc1)NC(CSC1=C(C#N)C(C(C(N1)=O)C(=O)OC)c1ccccc1[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7593 |
| logD: | 3.6651 |
| logSw: | -3.9749 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.419 |
| InChI Key: | CIRWYFGRXWSLRQ-UHFFFAOYSA-N |