1-[3-(3-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[5-methyl-2-(propan-2-yl)phenoxy]ethan-1-one
Chemical Structure Depiction of
1-[3-(3-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[5-methyl-2-(propan-2-yl)phenoxy]ethan-1-one
1-[3-(3-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[5-methyl-2-(propan-2-yl)phenoxy]ethan-1-one
Compound characteristics
| Compound ID: | 4607-1694 |
| Compound Name: | 1-[3-(3-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[5-methyl-2-(propan-2-yl)phenoxy]ethan-1-one |
| Molecular Weight: | 499.33 |
| Molecular Formula: | C22 H22 Br F3 N2 O3 |
| Smiles: | CC(C)c1ccc(C)cc1OCC(N1C(CC(c2cccc(c2)[Br])=N1)(C(F)(F)F)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7297 |
| logD: | 5.7297 |
| logSw: | -5.2948 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.576 |
| InChI Key: | VJQALXWPUBGGGR-NRFANRHFSA-N |