Base information
| Cat. No. | |
| CAS No. | 860-22-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H11N2NaO8S2 |
| Molecular Weight | 446.387 |
| Exact Mass | 445.985 |
| XLogP3 | 3.8583 |
| Mr | 102.154 |
| PSA | 183.7 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 42 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=C1C(=C2Nc3c(C2=O)cc(cc3)S(=O)(=O)O)Nc2c1cc(cc2)S(=O)(=O)O.[NaH] |
