2-cyano-3-[1-(4-ethylphenyl)-1H-pyrrol-2-yl]-N~1~-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(4-ethylphenyl)-1H-pyrrol-2-yl]-N~1~-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[1-(4-ethylphenyl)-1H-pyrrol-2-yl]-N~1~-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C370-4469 |
| Compound Name: | 2-cyano-3-[1-(4-ethylphenyl)-1H-pyrrol-2-yl]-N~1~-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C24 H18 F N5 O S |
| Smiles: | CCc1ccc(cc1)n1cccc1/C=C(/C#N)C(Nc1nnc(c2ccc(cc2)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.13 |
| logD: | 6.05 |
| logSw: | -7.04 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 138.9 |
| InChI Key: | OEYYLSWAEQTDAP-UHFFFAOYSA-N |