Base information
| Cat. No. | |
| CAS No. | 101-59-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H10N2O2S |
| Molecular Weight | 246.285 |
| Exact Mass | 246.046 |
| XLogP3 | 4.4326 |
| Mr | 70.2334 |
| PSA | 97.14 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Nc1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-] |
