Base information
| Cat. No. | |
| CAS No. | 487021-52-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12N4O4S |
| Molecular Weight | 308.313 |
| Exact Mass | 308.058 |
| XLogP3 | 3.3687 |
| Mr | 79.4184 |
| PSA | 137.31 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 34 |
| Ring number | 2 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1)CNC(=O)Nc1ncc(s1)[N+](=O)[O-] |
