1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(2-methylphenyl)methanesulfonyl]piperazine
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(2-methylphenyl)methanesulfonyl]piperazine
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(2-methylphenyl)methanesulfonyl]piperazine
Compound characteristics
| Compound ID: | Y300-2793 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(2-methylphenyl)methanesulfonyl]piperazine |
| Molecular Weight: | 388.48 |
| Molecular Formula: | C20 H24 N2 O4 S |
| Smiles: | Cc1ccccc1CS(N1CCN(CC1)Cc1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.16 |
| logD: | 3.0841 |
| logSw: | -3.0768 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.5 |
| InChI Key: | XCHQBRAWAXRTLA-UHFFFAOYSA-N |