2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-fluorophenyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-fluorophenyl)acrylamide
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-fluorophenyl)acrylamide
Compound characteristics
| Compound ID: | C146-1189 |
| Compound Name: | 2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-fluorophenyl)acrylamide |
| Molecular Weight: | 334.39 |
| Molecular Formula: | C14 H11 F N4 O S2 |
| Smiles: | CCSc1nc(NC(C(=C/c2ccc(cc2)F)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 3.94 |
| logD: | 3.27 |
| logSw: | -4.87 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 170.18 |
| InChI Key: | YIMVJZVMIVHASG-UHFFFAOYSA-N |