2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(2-thienyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(2-thienyl)acrylamide
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(2-thienyl)acrylamide
Compound characteristics
| Compound ID: | C146-1219 |
| Compound Name: | 2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(2-thienyl)acrylamide |
| Molecular Weight: | 322.43 |
| Molecular Formula: | C12 H10 N4 O S3 |
| Smiles: | CCSc1nc(NC(C(=C/c2cccs2)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 3.46 |
| logD: | 2.64 |
| logSw: | -4.28 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 164.01 |
| InChI Key: | OACQTRSUZXVTOW-UHFFFAOYSA-N |