4-(2-ethoxyphenyl)-6-(methylsulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
Chemical Structure Depiction of
4-(2-ethoxyphenyl)-6-(methylsulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
4-(2-ethoxyphenyl)-6-(methylsulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
Compound characteristics
| Compound ID: | 3329-3799 |
| Compound Name: | 4-(2-ethoxyphenyl)-6-(methylsulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile |
| Molecular Weight: | 313.38 |
| Molecular Formula: | C16 H15 N3 O2 S |
| Smiles: | CCOc1ccccc1C1C(C#N)C(NC(=C1C#N)SC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2468 |
| logD: | 2.1021 |
| logSw: | -2.7932 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.51 |
| InChI Key: | ACJTUEFXZGJJGH-UHFFFAOYSA-N |