2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(3-pyridyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(3-pyridyl)acrylamide
2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(3-pyridyl)acrylamide
Compound characteristics
| Compound ID: | C146-0533 |
| Compound Name: | 2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(3-pyridyl)acrylamide |
| Molecular Weight: | 303.36 |
| Molecular Formula: | C12 H9 N5 O S2 |
| Smiles: | CSc1nc(NC(C(=C/c2cccnc2)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 2.35 |
| logD: | 1.61 |
| logSw: | -3.65 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 191.81 |
| InChI Key: | KKYOSENWIPOQCD-UHFFFAOYSA-N |