3-(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)-2-cyano-N-(2-methylphenyl)prop-2-enamide
Chemical Structure Depiction of
3-(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)-2-cyano-N-(2-methylphenyl)prop-2-enamide
3-(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)-2-cyano-N-(2-methylphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | C639-0190 |
| Compound Name: | 3-(5-{[(4-chlorophenyl)methyl]sulfanyl}furan-2-yl)-2-cyano-N-(2-methylphenyl)prop-2-enamide |
| Molecular Weight: | 408.9 |
| Molecular Formula: | C22 H17 Cl N2 O2 S |
| Smiles: | Cc1ccccc1NC(C(=C\c1ccc(o1)SCc1ccc(cc1)[Cl])\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4933 |
| logD: | 5.4911 |
| logSw: | -5.9135 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.478 |
| InChI Key: | JPDRHBDHBREEAT-UHFFFAOYSA-N |