2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(3,4,5-trimethoxyphenyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(3,4,5-trimethoxyphenyl)acrylamide
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(3,4,5-trimethoxyphenyl)acrylamide
Compound characteristics
| Compound ID: | C146-1211 |
| Compound Name: | 2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(3,4,5-trimethoxyphenyl)acrylamide |
| Molecular Weight: | 406.48 |
| Molecular Formula: | C17 H18 N4 O4 S2 |
| Smiles: | CCSc1nc(NC(C(=C/c2cc(c(c(c2)OC)OC)OC)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 3.66 |
| logD: | 2.99 |
| logSw: | -4.38 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 199.71 |
| InChI Key: | ZTFCGTDCTWSUMD-UHFFFAOYSA-N |