1-[(4-nitrophenyl)methyl]-4-(propan-2-yl)piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(4-nitrophenyl)methyl]-4-(propan-2-yl)piperazine--oxalic acid (1/1)
1-[(4-nitrophenyl)methyl]-4-(propan-2-yl)piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4262-0391 |
| Compound Name: | 1-[(4-nitrophenyl)methyl]-4-(propan-2-yl)piperazine--oxalic acid (1/1) |
| Molecular Weight: | 353.37 |
| Molecular Formula: | C14 H21 N3 O2 |
| Salt: | HOOCCOOH |
| Smiles: | CC(C)N1CCN(CC1)Cc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2065 |
| logD: | 0.9422 |
| logSw: | -2.4037 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.216 |
| InChI Key: | YMVRNKOYZPEJAJ-UHFFFAOYSA-N |