Base information
| Cat. No. | |
| CAS No. | 129051-18-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C44H38Cl4N8 |
| Molecular Weight | 820.638 |
| Exact Mass | 818.197 |
| XLogP3 | -9.8198 |
| Mr | 241.245 |
| PSA | 71.82 |
| Sequence | - |
| Atom number | 94 |
| Bond number | 98 |
| Ring number | 9 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | C[n+]1ccccc1/C/1=C/2\C=CC(=N2)/C(=c\2/cc/c(=C(/c3[nH]c(/C(=C/4\N=C1C=C4)/c1cccc[n+]1C)cc3)\c1cccc[n+]1C)/[nH]2)/c1cccc[n+]1C.[Cl-].[Cl-].[Cl-].[Cl-] |
