5-[chloro(difluoro)methyl]-1-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-4,5-dihydro-1H-pyrazol-5-ol
Chemical Structure Depiction of
5-[chloro(difluoro)methyl]-1-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-4,5-dihydro-1H-pyrazol-5-ol
5-[chloro(difluoro)methyl]-1-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-4,5-dihydro-1H-pyrazol-5-ol
Compound characteristics
| Compound ID: | Y502-7985 |
| Compound Name: | 5-[chloro(difluoro)methyl]-1-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]-3-methyl-4,5-dihydro-1H-pyrazol-5-ol |
| Molecular Weight: | 466.79 |
| Molecular Formula: | C18 H16 Cl F5 N4 O3 |
| Smiles: | CC1CC(C(F)(F)[Cl])(N(c2nc(cc(C(F)(F)F)n2)c2ccc(c(c2)OC)OC)N=1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6047 |
| logD: | 4.604 |
| logSw: | -4.5556 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.254 |
| InChI Key: | MVJTZRLDTJVFMO-INIZCTEOSA-N |