2-cyano-3-[1-(3,4-dichlorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(3,4-dichlorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[1-(3,4-dichlorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C370-5552 |
| Compound Name: | 2-cyano-3-[1-(3,4-dichlorophenyl)-1H-pyrrol-2-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 458.25 |
| Molecular Formula: | C17 H8 Cl2 F3 N5 O S |
| Smiles: | C(=C(/C#N)C(Nc1nnc(C(F)(F)F)s1)=O)\c1cccn1c1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.68 |
| logD: | 1.24 |
| logSw: | -6.83 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 133.3 |
| InChI Key: | QXNLRMISAVZFFN-UHFFFAOYSA-N |