1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0578 |
| Compound Name: | 1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 551.55 |
| Molecular Formula: | C23 H31 N3 O7 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cc(CN2CCN(CC2)Cc2cc(c(c(c2)OC)OC)OC)c(cc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3562 |
| logD: | -0.0147 |
| logSw: | -2.4776 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.831 |
| InChI Key: | JXBBNLPURWACDM-UHFFFAOYSA-N |