{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Chemical Structure Depiction of
{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Compound characteristics
| Compound ID: | Y501-8333 |
| Compound Name: | {4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone |
| Molecular Weight: | 459.26 |
| Molecular Formula: | C18 H18 Br F3 N4 O2 |
| Smiles: | CC1CC(C(F)(F)F)(N(C(c2ccc(Cn3c(C)c(c(C)n3)[Br])cc2)=O)N=1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.742 |
| logD: | 2.742 |
| logSw: | -2.7976 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.245 |
| InChI Key: | MUDROFVVGAGUDR-KRWDZBQOSA-N |