6-oxo-4-phenyl-2-(propylsulfanyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
6-oxo-4-phenyl-2-(propylsulfanyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
6-oxo-4-phenyl-2-(propylsulfanyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 3331-3804 |
| Compound Name: | 6-oxo-4-phenyl-2-(propylsulfanyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 272.37 |
| Molecular Formula: | C15 H16 N2 O S |
| Smiles: | CCCSC1=C(C#N)C(CC(N1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7877 |
| logD: | 2.7304 |
| logSw: | -3.2385 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.187 |
| InChI Key: | UTGUYJLSUANKRJ-GFCCVEGCSA-N |