3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C146-0159 |
| Compound Name: | 3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 402.88 |
| Molecular Formula: | C17 H11 Cl N4 O2 S2 |
| Smiles: | CSc1nc(NC(C(=C/c2ccc(c3ccc(cc3)[Cl])o2)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 5.3 |
| logD: | 4.61 |
| logSw: | -6.24 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 175.47 |
| InChI Key: | HDPCLIQWUJUKLL-UHFFFAOYSA-N |