{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3-methylphenyl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3-methylphenyl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3-methylphenyl)methanone
Compound characteristics
| Compound ID: | 8013-3818 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3-methylphenyl)methanone |
| Molecular Weight: | 338.4 |
| Molecular Formula: | C20 H22 N2 O3 |
| Smiles: | Cc1cccc(c1)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5764 |
| logD: | 2.3848 |
| logSw: | -2.675 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.543 |
| InChI Key: | YLEAUZRUDYETMU-UHFFFAOYSA-N |