2-cyano-3-[1-(3-fluorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(3-fluorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[1-(3-fluorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C370-4336 |
| Compound Name: | 2-cyano-3-[1-(3-fluorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 421.47 |
| Molecular Formula: | C20 H12 F N5 O S2 |
| Smiles: | C(=C(/C#N)C(Nc1nnc(c2cccs2)s1)=O)\c1cccn1c1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.06 |
| logD: | 4.95 |
| logSw: | -6.08 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 137.31 |
| InChI Key: | XCUIFKDBDCHJFK-UHFFFAOYSA-N |