Base information
| Cat. No. | |
| CAS No. | 207233-90-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H8N2Na2O6S4 |
| Molecular Weight | 498.484 |
| Exact Mass | 497.906 |
| XLogP3 | 5.2954 |
| Mr | 107.199 |
| PSA | 220.06 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 37 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | S=C=Nc1ccc(c(c1)S(=O)(=O)[O-])/C=C/c1ccc(cc1S(=O)(=O)[O-])N=C=S.[Na+].[Na+] |
