1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(methylsulfanyl)benzene-1-sulfonyl]piperazine
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(methylsulfanyl)benzene-1-sulfonyl]piperazine
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(methylsulfanyl)benzene-1-sulfonyl]piperazine
Compound characteristics
| Compound ID: | 8014-2526 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[4-(methylsulfanyl)benzene-1-sulfonyl]piperazine |
| Molecular Weight: | 406.52 |
| Molecular Formula: | C19 H22 N2 O4 S2 |
| Smiles: | CSc1ccc(cc1)S(N1CCN(CC1)Cc1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2802 |
| logD: | 3.1851 |
| logSw: | -3.4968 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 52.605 |
| InChI Key: | MUQQAMPVUMLYOY-UHFFFAOYSA-N |