methyl 1,2-dimethyl-4-[4-(methylsulfanyl)phenyl]-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
methyl 1,2-dimethyl-4-[4-(methylsulfanyl)phenyl]-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
methyl 1,2-dimethyl-4-[4-(methylsulfanyl)phenyl]-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 8018-4185 |
| Compound Name: | methyl 1,2-dimethyl-4-[4-(methylsulfanyl)phenyl]-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 305.39 |
| Molecular Formula: | C16 H19 N O3 S |
| Smiles: | CC1=C(C(CC(N1C)=O)c1ccc(cc1)SC)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3844 |
| logD: | 2.3844 |
| logSw: | -2.6734 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.059 |
| InChI Key: | SIEKKIWFTSHCIY-ZDUSSCGKSA-N |