3-(2-chlorophenyl)-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
3-(2-chlorophenyl)-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
3-(2-chlorophenyl)-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C146-0523 |
| Compound Name: | 3-(2-chlorophenyl)-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 336.82 |
| Molecular Formula: | C13 H9 Cl N4 O S2 |
| Smiles: | CSc1nc(NC(C(=C/c2ccccc2[Cl])\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 3.93 |
| logD: | 2.41 |
| logSw: | -4.71 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 168.29 |
| InChI Key: | GLVDNGFQRIOLLZ-UHFFFAOYSA-N |