Base information
| Cat. No. | |
| CAS No. | 55266-18-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C48H28ClMnN4O8 |
| Molecular Weight | 879.149 |
| Exact Mass | 878.098 |
| XLogP3 | 2.4569 |
| Mr | 232.445 |
| PSA | 213.99 |
| Sequence | - |
| Atom number | 90 |
| Bond number | 96 |
| Ring number | 9 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | [O-]C(=O)c1ccc(cc1)/C/1=C/2\C=CC(=N2)/C(=c\2/cc/c(=C(/c3[nH]c(/C(=C/4\N=C1C=C4)/c1ccc(cc1)C(=O)[O-])cc3)\c1ccc(cc1)C(=O)O)/[nH]2)/c1ccc(cc1)C(=O)[O-].[Mn+3].Cl |
