1-[(3-bromo-4-methoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(3-bromo-4-methoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
1-[(3-bromo-4-methoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0744 |
| Compound Name: | 1-[(3-bromo-4-methoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 555.42 |
| Molecular Formula: | C22 H29 Br N2 O4 |
| Salt: | HOOCCOOH |
| Smiles: | COc1ccc(CN2CCN(CC2)Cc2cc(c(c(c2)OC)OC)OC)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.0906 |
| logD: | 0.7197 |
| logSw: | -3.0525 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.12 |
| InChI Key: | HYRJILDJLQMSMC-UHFFFAOYSA-N |