2-(3,4-dimethoxyphenyl)-1-[5-hydroxy-3-(propan-2-yl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-1-[5-hydroxy-3-(propan-2-yl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(3,4-dimethoxyphenyl)-1-[5-hydroxy-3-(propan-2-yl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 5438-0019 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-1-[5-hydroxy-3-(propan-2-yl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 374.36 |
| Molecular Formula: | C17 H21 F3 N2 O4 |
| Smiles: | CC(C)C1CC(C(F)(F)F)(N(C(Cc2ccc(c(c2)OC)OC)=O)N=1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6798 |
| logD: | 2.6797 |
| logSw: | -2.7566 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.523 |
| InChI Key: | PKSPKKIESFBMLT-INIZCTEOSA-N |