5-[(2-chlorophenyl)methoxy]-2-{[4-(3,5-dichlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Chemical Structure Depiction of
5-[(2-chlorophenyl)methoxy]-2-{[4-(3,5-dichlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
5-[(2-chlorophenyl)methoxy]-2-{[4-(3,5-dichlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Compound characteristics
| Compound ID: | V008-0802 |
| Compound Name: | 5-[(2-chlorophenyl)methoxy]-2-{[4-(3,5-dichlorobenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one |
| Molecular Weight: | 543.85 |
| Molecular Formula: | C23 H21 Cl3 N2 O5 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CC1=CC(C(=CO1)OCc1ccccc1[Cl])=O)S(c1cc(cc(c1)[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2618 |
| logD: | 4.2616 |
| logSw: | -4.3719 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.402 |
| InChI Key: | HWNABWCQXOYUIT-UHFFFAOYSA-N |