2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(3,4,5-trimethoxyphenyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(3,4,5-trimethoxyphenyl)acrylamide
2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(3,4,5-trimethoxyphenyl)acrylamide
Compound characteristics
| Compound ID: | C355-0570 |
| Compound Name: | 2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(3,4,5-trimethoxyphenyl)acrylamide |
| Molecular Weight: | 438.48 |
| Molecular Formula: | C17 H18 N4 O6 S2 |
| Smiles: | CCS(c1nc(NC(C(=C/c2cc(c(c(c2)OC)OC)OC)\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.25 |
| logD: | -0.11 |
| logSw: | -3.68 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 223.23 |
| InChI Key: | WSRBVUUDEWKOOR-UHFFFAOYSA-N |