1-[(3,4-dimethoxyphenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(3,4-dimethoxyphenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
1-[(3,4-dimethoxyphenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0877 |
| Compound Name: | 1-[(3,4-dimethoxyphenyl)methyl]-4-[(3-nitrophenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 461.47 |
| Molecular Formula: | C20 H25 N3 O4 |
| Salt: | HOOCCOOH |
| Smiles: | COc1ccc(CN2CCN(CC2)Cc2cccc(c2)[N+]([O-])=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.3785 |
| logD: | 1.4072 |
| logSw: | -2.5052 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.154 |
| InChI Key: | SEOAUWSQSIANOK-UHFFFAOYSA-N |