1-[5-(3-bromophenyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]-2,2,2-trifluoroethan-1-one
Chemical Structure Depiction of
1-[5-(3-bromophenyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]-2,2,2-trifluoroethan-1-one
1-[5-(3-bromophenyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]-2,2,2-trifluoroethan-1-one
Compound characteristics
| Compound ID: | 8007-5016 |
| Compound Name: | 1-[5-(3-bromophenyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]-2,2,2-trifluoroethan-1-one |
| Molecular Weight: | 351.12 |
| Molecular Formula: | C12 H10 Br F3 N2 O2 |
| Smiles: | CC1CC(c2cccc(c2)[Br])(N(C(C(F)(F)F)=O)N=1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9775 |
| logD: | 2.9775 |
| logSw: | -3.0315 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.963 |
| InChI Key: | VTRFLPOGOVYVBV-NSHDSACASA-N |