3-[5-(3-chlorophenyl)-2-furyl]-2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
3-[5-(3-chlorophenyl)-2-furyl]-2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
3-[5-(3-chlorophenyl)-2-furyl]-2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C356-0541 |
| Compound Name: | 3-[5-(3-chlorophenyl)-2-furyl]-2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 448.9 |
| Molecular Formula: | C18 H13 Cl N4 O4 S2 |
| Smiles: | CCS(c1nnc(NC(C(=C/c2ccc(c3cccc(c3)[Cl])o2)\C#N)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.38 |
| logD: | 2.01 |
| logSw: | -5.07 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 204.78 |
| InChI Key: | VAXGADXWIHHQSN-UHFFFAOYSA-N |