1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(naphthalen-1-yl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(naphthalen-1-yl)methyl]piperazine--oxalic acid (1/1)
1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(naphthalen-1-yl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3702-0795 |
| Compound Name: | 1-[(4,5-dimethoxy-2-nitrophenyl)methyl]-4-[(naphthalen-1-yl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 511.53 |
| Molecular Formula: | C24 H27 N3 O4 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cc(CN2CCN(CC2)Cc2cccc3ccccc23)c(cc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9313 |
| logD: | 3.4204 |
| logSw: | -4.1916 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.581 |
| InChI Key: | PEFYMVVGAZUCDP-UHFFFAOYSA-N |