1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-chloro-2,5-dimethoxybenzene-1-sulfonyl)piperazine
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-chloro-2,5-dimethoxybenzene-1-sulfonyl)piperazine
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-chloro-2,5-dimethoxybenzene-1-sulfonyl)piperazine
Compound characteristics
| Compound ID: | 7065-0113 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-chloro-2,5-dimethoxybenzene-1-sulfonyl)piperazine |
| Molecular Weight: | 454.93 |
| Molecular Formula: | C20 H23 Cl N2 O6 S |
| Smiles: | COc1cc(c(cc1S(N1CCN(CC1)Cc1ccc2c(c1)OCO2)(=O)=O)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9202 |
| logD: | 2.825 |
| logSw: | -3.3897 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.866 |
| InChI Key: | OPRXGPMBHQXMOR-UHFFFAOYSA-N |