{4-[(2-nitrophenyl)methyl]piperazin-1-yl}(pyridin-3-yl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
{4-[(2-nitrophenyl)methyl]piperazin-1-yl}(pyridin-3-yl)methanone--oxalic acid (1/1)
{4-[(2-nitrophenyl)methyl]piperazin-1-yl}(pyridin-3-yl)methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0403 |
| Compound Name: | {4-[(2-nitrophenyl)methyl]piperazin-1-yl}(pyridin-3-yl)methanone--oxalic acid (1/1) |
| Molecular Weight: | 416.39 |
| Molecular Formula: | C17 H18 N4 O3 |
| Salt: | HOOCCOOH |
| Smiles: | C1CN(CCN1Cc1ccccc1[N+]([O-])=O)C(c1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1398 |
| logD: | 1.1356 |
| logSw: | -1.3064 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.026 |
| InChI Key: | OEJJHABLRHIJLI-UHFFFAOYSA-N |