3-[5-(2-chlorophenyl)-2-furyl]-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
3-[5-(2-chlorophenyl)-2-furyl]-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
3-[5-(2-chlorophenyl)-2-furyl]-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 3948-0444 |
| Compound Name: | 3-[5-(2-chlorophenyl)-2-furyl]-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 424.79 |
| Molecular Formula: | C17 H8 Cl F3 N4 O2 S |
| Smiles: | C(=C(/C#N)C(Nc1nnc(C(F)(F)F)s1)=O)\c1ccc(c2ccccc2[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 5.11 |
| logD: | 0.56 |
| logSw: | -6.15 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 139.08 |
| InChI Key: | YLVOJIMBJJMIMH-UHFFFAOYSA-N |