3-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
3-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
3-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 4277-0684 |
| Compound Name: | 3-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 496.31 |
| Molecular Formula: | C19 H13 Br F3 N5 O S |
| Smiles: | Cc1cc(/C=C(/C#N)C(Nc2nnc(C(F)(F)F)s2)=O)c(C)n1c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.14 |
| logD: | 1.3 |
| logSw: | -6.19 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 135.29 |
| InChI Key: | YVPNKDPZRHJHCB-UHFFFAOYSA-N |