Base information
| Cat. No. | |
| CAS No. | 6359-86-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H12N5NaO7S |
| Molecular Weight | 441.351 |
| Exact Mass | 441.036 |
| XLogP3 | 4.4236 |
| Mr | 100.023 |
| PSA | 194.4 |
| Sequence | - |
| Atom number | 42 |
| Bond number | 43 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | Cc1nn(c(c1/N=N/c1cc(ccc1O)[N+](=O)[O-])O)c1ccc(cc1)S(=O)(=O)[O-].[Na+] |
