{4-[(4-nitrophenyl)methyl]piperazin-1-yl}(pyridin-4-yl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
{4-[(4-nitrophenyl)methyl]piperazin-1-yl}(pyridin-4-yl)methanone--oxalic acid (1/1)
{4-[(4-nitrophenyl)methyl]piperazin-1-yl}(pyridin-4-yl)methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 2910-0871 |
| Compound Name: | {4-[(4-nitrophenyl)methyl]piperazin-1-yl}(pyridin-4-yl)methanone--oxalic acid (1/1) |
| Molecular Weight: | 416.39 |
| Molecular Formula: | C17 H18 N4 O3 |
| Salt: | HOOCCOOH |
| Smiles: | C1CN(CCN1Cc1ccc(cc1)[N+]([O-])=O)C(c1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0948 |
| logD: | 1.084 |
| logSw: | -1.5857 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.237 |
| InChI Key: | BPICWXIHFSBYIZ-UHFFFAOYSA-N |