4-(4-fluorophenyl)-2-(hexylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
4-(4-fluorophenyl)-2-(hexylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
4-(4-fluorophenyl)-2-(hexylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 3448-4324 |
| Compound Name: | 4-(4-fluorophenyl)-2-(hexylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 332.44 |
| Molecular Formula: | C18 H21 F N2 O S |
| Smiles: | CCCCCCSC1=C(C#N)C(CC(N1)=O)c1ccc(cc1)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6733 |
| logD: | 4.6159 |
| logSw: | -4.3744 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.187 |
| InChI Key: | WSMQLRBMRIQRPL-OAHLLOKOSA-N |