2-(3,5-dimethylphenoxy)-1-[5-hydroxy-3-(2-methylpropyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3,5-dimethylphenoxy)-1-[5-hydroxy-3-(2-methylpropyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(3,5-dimethylphenoxy)-1-[5-hydroxy-3-(2-methylpropyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 4607-1315 |
| Compound Name: | 2-(3,5-dimethylphenoxy)-1-[5-hydroxy-3-(2-methylpropyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 372.39 |
| Molecular Formula: | C18 H23 F3 N2 O3 |
| Smiles: | CC(C)CC1CC(C(F)(F)F)(N(C(COc2cc(C)cc(C)c2)=O)N=1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9007 |
| logD: | 3.9006 |
| logSw: | -3.8923 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.665 |
| InChI Key: | HXASGRQPYOAXDE-KRWDZBQOSA-N |