1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,5-dichloro-4-methoxybenzene-1-sulfonyl)piperazine
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,5-dichloro-4-methoxybenzene-1-sulfonyl)piperazine
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,5-dichloro-4-methoxybenzene-1-sulfonyl)piperazine
Compound characteristics
| Compound ID: | 8014-1689 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,5-dichloro-4-methoxybenzene-1-sulfonyl)piperazine |
| Molecular Weight: | 459.35 |
| Molecular Formula: | C19 H20 Cl2 N2 O5 S |
| Smiles: | COc1cc(c(cc1[Cl])S(N1CCN(CC1)Cc1ccc2c(c1)OCO2)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3889 |
| logD: | 3.2938 |
| logSw: | -3.6948 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.236 |
| InChI Key: | GRDZUQVGPJVUJR-UHFFFAOYSA-N |