1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-ethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-ethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-ethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4964-3323 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-ethoxyphenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 444.48 |
| Molecular Formula: | C21 H26 N2 O3 |
| Salt: | HOOCCOOH |
| Smiles: | CCOc1ccc(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1834 |
| logD: | 2.2122 |
| logSw: | -3.0736 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.75 |
| InChI Key: | NPPTUWXEYXPLOR-UHFFFAOYSA-N |