Base information
| Cat. No. | |
| CAS No. | 5423-07-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H11N4NaO11S2 |
| Molecular Weight | 522.399 |
| Exact Mass | 521.976 |
| XLogP3 | 6.5911 |
| Mr | 115.063 |
| PSA | 262.09 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 46 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | Oc1c2ccc(cc2cc(c1/N=N/c1ccc(cc1N(=O)=O)N(=O)=O)S(=O)(=O)O)S(=O)(=O)O.[NaH] |
