Base information
| Cat. No. | |
| CAS No. | 155860-63-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11N5O5S |
| Molecular Weight | 337.311 |
| Exact Mass | 337.048 |
| XLogP3 | 3.2715 |
| Mr | 81.1314 |
| PSA | 155.25 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 35 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | O=C(NS(=O)(=O)c1ccccc1[N+](=O)[O-])Nc1nccc(n1)C |
