3-{[5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione
Chemical Structure Depiction of
3-{[5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione
3-{[5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | 5594-3102 |
| Compound Name: | 3-{[5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione |
| Molecular Weight: | 432.42 |
| Molecular Formula: | C20 H15 F3 N4 O2 S |
| Smiles: | Cc1ccc(cc1)c1nnc([nH]1)SC1CC(N(C1=O)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3946 |
| logD: | 2.0622 |
| logSw: | -3.8395 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.665 |
| InChI Key: | UVXNNWUGXUKGAB-HNNXBMFYSA-N |