Base information
| Cat. No. | |
| CAS No. | 12225-67-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C40H18Cl4CrN12Na2O12S2 |
| Molecular Weight | 1163.57 |
| Exact Mass | 1160.86 |
| XLogP3 | 10.1116 |
| Mr | 241.343 |
| PSA | 408.38 |
| Sequence | - |
| Atom number | 92 |
| Bond number | 94 |
| Ring number | 8 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | Clc1nc(Nc2ccc3c(c2)cc(c(c3[O-])/N=N/c2ccccc2C(=O)[O-])S(=O)(=O)[O-])nc(n1)Cl.Clc1nc(Nc2ccc3c(c2)cc(c(c3[O-])/N=N/c2ccccc2C(=O)[O-])S(=O)(=O)[O-])nc(n1)Cl.[H+].[Na+].[Na+].[Cr+3] |
