1-[3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-[3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethan-1-one
1-[3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | 4607-1605 |
| Compound Name: | 1-[3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethan-1-one |
| Molecular Weight: | 471.27 |
| Molecular Formula: | C20 H18 Br F3 N2 O3 |
| Smiles: | Cc1ccc(cc1C)OCC(N1C(CC(c2ccc(cc2)[Br])=N1)(C(F)(F)F)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9954 |
| logD: | 4.9953 |
| logSw: | -4.631 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.49 |
| InChI Key: | JCXFOPSPPOVCLT-IBGZPJMESA-N |