3-{5-[(4-chlorophenyl)sulfanyl]-2-furyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-{5-[(4-chlorophenyl)sulfanyl]-2-furyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-{5-[(4-chlorophenyl)sulfanyl]-2-furyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0088 |
| Compound Name: | 3-{5-[(4-chlorophenyl)sulfanyl]-2-furyl}-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 385.83 |
| Molecular Formula: | C18 H12 Cl N3 O3 S |
| Smiles: | Cc1cc(NC(C(=C/c2ccc(o2)Sc2ccc(cc2)[Cl])\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.46 |
| logD: | 3.93 |
| logSw: | -6.39 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 191.44 |
| InChI Key: | FBPNFWSIDUXNRB-UHFFFAOYSA-N |