3-anilino-2-cyano-3-{[(2-fluorophenyl)methyl]sulfanyl}-N-(2-methylphenyl)prop-2-enamide
Chemical Structure Depiction of
3-anilino-2-cyano-3-{[(2-fluorophenyl)methyl]sulfanyl}-N-(2-methylphenyl)prop-2-enamide
3-anilino-2-cyano-3-{[(2-fluorophenyl)methyl]sulfanyl}-N-(2-methylphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | K291-0058 |
| Compound Name: | 3-anilino-2-cyano-3-{[(2-fluorophenyl)methyl]sulfanyl}-N-(2-methylphenyl)prop-2-enamide |
| Molecular Weight: | 417.5 |
| Molecular Formula: | C24 H20 F N3 O S |
| Smiles: | Cc1ccccc1NC(C(\C#N)=C(/Nc1ccccc1)SCc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4366 |
| logD: | 5.4353 |
| logSw: | -5.3598 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.38 |
| InChI Key: | SVRZWFJMWSKYDR-UHFFFAOYSA-N |