1-[(3-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(3-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
1-[(3-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0952 |
| Compound Name: | 1-[(3-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 431.44 |
| Molecular Formula: | C19 H23 N3 O3 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cccc(CN2CCN(CC2)Cc2ccc(cc2)[N+]([O-])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9243 |
| logD: | 1.7135 |
| logSw: | -3.2249 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.437 |
| InChI Key: | XIJFQUIYWGHABG-UHFFFAOYSA-N |