4-(4-methoxyphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
4-(4-methoxyphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
4-(4-methoxyphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 2188-0743 |
| Compound Name: | 4-(4-methoxyphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 274.34 |
| Molecular Formula: | C14 H14 N2 O2 S |
| Smiles: | COc1ccc(cc1)C1CC(NC(=C1C#N)SC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0013 |
| logD: | 1.8566 |
| logSw: | -2.6113 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.731 |
| InChI Key: | QUKCNUZTLLKGRG-LLVKDONJSA-N |