Base information
| Cat. No. | |
| CAS No. | 5858-33-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H12N2Na2O7S2 |
| Molecular Weight | 502.428 |
| Exact Mass | 501.988 |
| XLogP3 | 6.0838 |
| Mr | 110.11 |
| PSA | 176.11 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 46 |
| Ring number | 4 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | Oc1c(/N=N/c2cccc3c2cccc3)c2ccc(cc2cc1S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] |
