Base information
| Cat. No. | |
| CAS No. | 77944-88-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H8Li2N4O9S2 |
| Molecular Weight | 442.236 |
| Exact Mass | 442.005 |
| XLogP3 | 2.1814 |
| Mr | 90.7443 |
| PSA | 249.68 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 38 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | NNC(=O)N1C(=O)c2cc(cc3c2c(C1=O)cc(c3N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Li+].[Li+] |
