5-[(3,5-dimethylphenyl)methoxy]-2-{[4-(2,2,3,3,4,4,4-heptafluorobutanoyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Chemical Structure Depiction of
5-[(3,5-dimethylphenyl)methoxy]-2-{[4-(2,2,3,3,4,4,4-heptafluorobutanoyl)piperazin-1-yl]methyl}-4H-pyran-4-one
5-[(3,5-dimethylphenyl)methoxy]-2-{[4-(2,2,3,3,4,4,4-heptafluorobutanoyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Compound characteristics
| Compound ID: | V006-3743 |
| Compound Name: | 5-[(3,5-dimethylphenyl)methoxy]-2-{[4-(2,2,3,3,4,4,4-heptafluorobutanoyl)piperazin-1-yl]methyl}-4H-pyran-4-one |
| Molecular Weight: | 524.43 |
| Molecular Formula: | C23 H23 F7 N2 O4 |
| Salt: | not_available |
| Smiles: | Cc1cc(C)cc(COC2=COC(CN3CCN(CC3)C(C(C(C(F)(F)F)(F)F)(F)F)=O)=CC2=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6776 |
| logD: | 4.6775 |
| logSw: | -4.5736 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.611 |
| InChI Key: | SNYAVNHTLJYKLY-UHFFFAOYSA-N |