1-[1-benzoyl-5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethan-1-one
Chemical Structure Depiction of
1-[1-benzoyl-5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethan-1-one
1-[1-benzoyl-5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8013-5634 |
| Compound Name: | 1-[1-benzoyl-5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethan-1-one |
| Molecular Weight: | 296.25 |
| Molecular Formula: | C14 H11 F3 N2 O2 |
| Smiles: | CC(c1c(C(F)(F)F)nn(C(c2ccccc2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0667 |
| logD: | 2.0667 |
| logSw: | -2.1904 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.873 |
| InChI Key: | QAPSEDILQQYRIT-UHFFFAOYSA-N |