5-methyl-2-[3-(trifluoromethyl)phenyl]-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-methyl-2-[3-(trifluoromethyl)phenyl]-1,2-dihydro-3H-pyrazol-3-one
5-methyl-2-[3-(trifluoromethyl)phenyl]-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y507-3059 |
| Compound Name: | 5-methyl-2-[3-(trifluoromethyl)phenyl]-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 242.2 |
| Molecular Formula: | C11 H9 F3 N2 O |
| Smiles: | CC1=CC(N(c2cccc(c2)C(F)(F)F)N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4515 |
| logD: | 1.4851 |
| logSw: | -2.8776 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.3713 |
| InChI Key: | ZOZBHANUXDXBIN-UHFFFAOYSA-N |