2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-cyclohexylacetamide
Chemical Structure Depiction of
2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-cyclohexylacetamide
2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-cyclohexylacetamide
Compound characteristics
| Compound ID: | 4554-6450 |
| Compound Name: | 2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-cyclohexylacetamide |
| Molecular Weight: | 387.47 |
| Molecular Formula: | C20 H22 F N3 O2 S |
| Smiles: | C1CCC(CC1)NC(CSC1=C(C#N)C(CC(N1)=O)c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0075 |
| logD: | 2.9687 |
| logSw: | -3.3222 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.112 |
| InChI Key: | XEHNEMMPEFGSAQ-OAHLLOKOSA-N |