5-[(2-chlorophenyl)methoxy]-2-{[4-(2,4,6-trifluorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Chemical Structure Depiction of
5-[(2-chlorophenyl)methoxy]-2-{[4-(2,4,6-trifluorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
5-[(2-chlorophenyl)methoxy]-2-{[4-(2,4,6-trifluorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Compound characteristics
| Compound ID: | V004-5079 |
| Compound Name: | 5-[(2-chlorophenyl)methoxy]-2-{[4-(2,4,6-trifluorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one |
| Molecular Weight: | 528.93 |
| Molecular Formula: | C23 H20 Cl F3 N2 O5 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CC1=CC(C(=CO1)OCc1ccccc1[Cl])=O)S(c1c(cc(cc1F)F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1748 |
| logD: | 3.1746 |
| logSw: | -3.3982 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.402 |
| InChI Key: | MMWKSOJQTARVOJ-UHFFFAOYSA-N |