2-cyano-3-[1-(4-ethoxyphenyl)-1H-pyrrol-2-yl]-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(4-ethoxyphenyl)-1H-pyrrol-2-yl]-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
2-cyano-3-[1-(4-ethoxyphenyl)-1H-pyrrol-2-yl]-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C370-5094 |
| Compound Name: | 2-cyano-3-[1-(4-ethoxyphenyl)-1H-pyrrol-2-yl]-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C19 H17 N5 O2 S2 |
| Smiles: | CCOc1ccc(cc1)n1cccc1/C=C(/C#N)C(Nc1nc(ns1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.69 |
| logD: | 4.09 |
| logSw: | -5.39 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 179.9 |
| InChI Key: | JZXMKIDIEIGRLK-UHFFFAOYSA-N |