1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4262-0376 |
| Compound Name: | 1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 475.5 |
| Molecular Formula: | C21 H27 N3 O4 |
| Salt: | HOOCCOOH |
| Smiles: | CCOc1cc(CN2CCN(CC2)Cc2ccc(cc2)[N+]([O-])=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.5876 |
| logD: | 1.6163 |
| logSw: | -2.6973 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.734 |
| InChI Key: | CWVXQYGXYHPVJX-UHFFFAOYSA-N |