Base information
| Cat. No. | |
| CAS No. | 8005-52-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C27H20N6Na2O8S |
| Molecular Weight | 634.528 |
| Exact Mass | 634.086 |
| XLogP3 | 6.37 |
| Mr | 147.939 |
| PSA | 225.74 |
| Sequence | - |
| Atom number | 64 |
| Bond number | 65 |
| Ring number | 4 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | COc1cc(/N=N/c2cccc(c2)S(=O)(=O)[O-])ccc1NC(=O)Nc1ccc(cc1)/N=N/c1ccc(c(c1)C(=O)[O-])O.[Na+].[Na+] |
