1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-{[1-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}ethan-1-one
Chemical Structure Depiction of
1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-{[1-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}ethan-1-one
1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-{[1-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}ethan-1-one
Compound characteristics
| Compound ID: | Y500-3903 |
| Compound Name: | 1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-{[1-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}ethan-1-one |
| Molecular Weight: | 450.34 |
| Molecular Formula: | C18 H16 F6 N4 O3 |
| Smiles: | CC1CC(C(F)(F)F)(N(C(COc2cc(C(F)(F)F)nn2c2ccc(C)cc2)=O)N=1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4446 |
| logD: | 3.4446 |
| logSw: | -3.4466 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.429 |
| InChI Key: | IWNCDTLGYIALLV-INIZCTEOSA-N |