1-[2-nitro-4-(4-nitrobenzoyl)phenyl]pyridin-1-ium--chloride (1/1)
Chemical Structure Depiction of
1-[2-nitro-4-(4-nitrobenzoyl)phenyl]pyridin-1-ium--chloride (1/1)
1-[2-nitro-4-(4-nitrobenzoyl)phenyl]pyridin-1-ium--chloride (1/1)
Compound characteristics
| Compound ID: | 8015-5968 |
| Compound Name: | 1-[2-nitro-4-(4-nitrobenzoyl)phenyl]pyridin-1-ium--chloride (1/1) |
| Molecular Weight: | 385.76 |
| Molecular Formula: | C18 H12 N3 O5 |
| Salt: | Cl- |
| Smiles: | c1cc[n+](cc1)c1ccc(cc1[N+]([O-])=O)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4184 |
| logD: | 3.4184 |
| logSw: | -3.877 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 82.834 |
| InChI Key: | NEKQVAQDJBPPCU-UHFFFAOYSA-N |