1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3701-0494 |
| Compound Name: | 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 585.45 |
| Molecular Formula: | C23 H31 Br N2 O5 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cc(CN2CCN(CC2)Cc2cc(c(c(c2)OC)OC)OC)c(cc1OC)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.9395 |
| logD: | 0.5686 |
| logSw: | -2.9537 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.75 |
| InChI Key: | KURQYMCELUDPBS-UHFFFAOYSA-N |