2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-hydroxy-3-methoxyphenyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-hydroxy-3-methoxyphenyl)acrylamide
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-hydroxy-3-methoxyphenyl)acrylamide
Compound characteristics
| Compound ID: | C146-1206 |
| Compound Name: | 2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-hydroxy-3-methoxyphenyl)acrylamide |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C15 H14 N4 O3 S2 |
| Smiles: | CCSc1nc(NC(C(=C/c2ccc(c(c2)OC)O)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 3.1 |
| logD: | 2.42 |
| logSw: | -3.86 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 219.93 |
| InChI Key: | JKTUZJIWIQERFP-UHFFFAOYSA-N |