ethyl 5-cyano-6-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 5-cyano-6-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
ethyl 5-cyano-6-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 4296-0398 |
| Compound Name: | ethyl 5-cyano-6-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 495.55 |
| Molecular Formula: | C25 H25 N3 O6 S |
| Smiles: | CCOC(C1C(C(C#N)=C(NC1=O)SCC(Nc1cccc(c1)OC)=O)c1ccccc1OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4165 |
| logD: | 3.2853 |
| logSw: | -3.7892 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.05 |
| InChI Key: | MHBBKYYPBBRVQM-UHFFFAOYSA-N |