{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3,4-diethoxyphenyl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3,4-diethoxyphenyl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3,4-diethoxyphenyl)methanone
Compound characteristics
| Compound ID: | 4100-3513 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(3,4-diethoxyphenyl)methanone |
| Molecular Weight: | 412.49 |
| Molecular Formula: | C23 H28 N2 O5 |
| Smiles: | CCOc1ccc(cc1OCC)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3208 |
| logD: | 2.1292 |
| logSw: | -2.728 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.963 |
| InChI Key: | DKLCGGAUKFGLJA-UHFFFAOYSA-N |