2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)acrylamide
2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)acrylamide
Compound characteristics
| Compound ID: | C356-0571 |
| Compound Name: | 2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)acrylamide |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C15 H14 N4 O4 S2 |
| Smiles: | CCS(c1nnc(NC(C(=C/c2ccc(cc2)OC)\C#N)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.61 |
| logD: | 0.25 |
| logSw: | -3.79 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 216.83 |
| InChI Key: | HHMNDKRPXPELIZ-UHFFFAOYSA-N |