2-cyano-N~1~-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide
2-cyano-N~1~-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide
Compound characteristics
| Compound ID: | C508-0778 |
| Compound Name: | 2-cyano-N~1~-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-{5-[(2-furylmethyl)sulfanyl]-2-furyl}acrylamide |
| Molecular Weight: | 451.5 |
| Molecular Formula: | C22 H14 F N3 O3 S2 |
| Smiles: | C(c1ccco1)Sc1ccc(/C=C(/C#N)C(Nc2nc(cs2)c2ccc(cc2)F)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.29 |
| logD: | 6.28 |
| logSw: | -7.17 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 157.97 |
| InChI Key: | YLVSOTTXSIEUBJ-UHFFFAOYSA-N |