1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methanesulfonyl]piperazine
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methanesulfonyl]piperazine
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methanesulfonyl]piperazine
Compound characteristics
| Compound ID: | Y300-3048 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methanesulfonyl]piperazine |
| Molecular Weight: | 388.48 |
| Molecular Formula: | C20 H24 N2 O4 S |
| Smiles: | Cc1ccc(CS(N2CCN(CC2)Cc2ccc3c(c2)OCO3)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5837 |
| logD: | 2.5078 |
| logSw: | -2.8797 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.5 |
| InChI Key: | RIEFIBRBOHHDHQ-UHFFFAOYSA-N |