1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0561 |
| Compound Name: | 1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 521.52 |
| Molecular Formula: | C22 H29 N3 O6 |
| Salt: | HOOCCOOH |
| Smiles: | COc1ccc(CN2CCN(CC2)Cc2cc(c(cc2[N+]([O-])=O)OC)OC)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.2678 |
| logD: | 1.2965 |
| logSw: | -2.5108 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.114 |
| InChI Key: | VLWMRTVKNOHOST-UHFFFAOYSA-N |