2-cyano-N~1~-[3-(isobutylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(2-thienyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(isobutylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(2-thienyl)acrylamide
2-cyano-N~1~-[3-(isobutylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(2-thienyl)acrylamide
Compound characteristics
| Compound ID: | C146-5291 |
| Compound Name: | 2-cyano-N~1~-[3-(isobutylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(2-thienyl)acrylamide |
| Molecular Weight: | 350.48 |
| Molecular Formula: | C14 H14 N4 O S3 |
| Smiles: | CC(C)CSc1nc(NC(C(=C/c2cccs2)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 4.26 |
| logD: | 3.43 |
| logSw: | -4.76 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 166.81 |
| InChI Key: | SGBQKNZEBIAPFJ-UHFFFAOYSA-N |