4-(2-methylphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
4-(2-methylphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
4-(2-methylphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 3331-3756 |
| Compound Name: | 4-(2-methylphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 258.34 |
| Molecular Formula: | C14 H14 N2 O S |
| Smiles: | Cc1ccccc1C1CC(NC(=C1C#N)SC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5222 |
| logD: | 2.3775 |
| logSw: | -2.7713 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.187 |
| InChI Key: | SYNHLRVTXPNRQX-LLVKDONJSA-N |