1-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]piperazine--oxalic acid (1/1)
1-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3702-0649 |
| Compound Name: | 1-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 444.48 |
| Molecular Formula: | C21 H26 N2 O3 |
| Salt: | HOOCCOOH |
| Smiles: | Cc1ccc(CN2CCN(CC2)Cc2cc(c3c(c2)OCO3)OC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1766 |
| logD: | 0.8057 |
| logSw: | -3.0518 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.942 |
| InChI Key: | HETYIACULRSDST-UHFFFAOYSA-N |