2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-phenylacrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-phenylacrylamide
2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-phenylacrylamide
Compound characteristics
| Compound ID: | C146-0194 |
| Compound Name: | 2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-phenylacrylamide |
| Molecular Weight: | 302.37 |
| Molecular Formula: | C13 H10 N4 O S2 |
| Smiles: | CSc1nc(NC(C(=C/c2ccccc2)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 3.52 |
| logD: | 2.84 |
| logSw: | -4.34 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 172.55 |
| InChI Key: | CLGOGWAXWMCQTI-UHFFFAOYSA-N |