5-[(3,5-dimethylphenyl)methoxy]-2-({4-[4-fluoro-3-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-4H-pyran-4-one
Chemical Structure Depiction of
5-[(3,5-dimethylphenyl)methoxy]-2-({4-[4-fluoro-3-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-4H-pyran-4-one
5-[(3,5-dimethylphenyl)methoxy]-2-({4-[4-fluoro-3-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-4H-pyran-4-one
Compound characteristics
| Compound ID: | V008-5348 |
| Compound Name: | 5-[(3,5-dimethylphenyl)methoxy]-2-({4-[4-fluoro-3-(trifluoromethyl)benzoyl]piperazin-1-yl}methyl)-4H-pyran-4-one |
| Molecular Weight: | 518.51 |
| Molecular Formula: | C27 H26 F4 N2 O4 |
| Salt: | not_available |
| Smiles: | Cc1cc(C)cc(COC2=COC(CN3CCN(CC3)C(c3ccc(c(c3)C(F)(F)F)F)=O)=CC2=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6165 |
| logD: | 4.6161 |
| logSw: | -4.5564 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.339 |
| InChI Key: | UUVIRCFSSCXVQT-UHFFFAOYSA-N |