1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(3-methylphenyl)methanesulfonyl]piperazine
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(3-methylphenyl)methanesulfonyl]piperazine
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(3-methylphenyl)methanesulfonyl]piperazine
Compound characteristics
| Compound ID: | Y300-2938 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(3-methylphenyl)methanesulfonyl]piperazine |
| Molecular Weight: | 388.48 |
| Molecular Formula: | C20 H24 N2 O4 S |
| Smiles: | Cc1cccc(CS(N2CCN(CC2)Cc2ccc3c(c2)OCO3)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.0844 |
| logD: | 3.0085 |
| logSw: | -3.1293 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.5 |
| InChI Key: | DFQFJTSALMIHIK-UHFFFAOYSA-N |