Base information
| Cat. No. | |
| CAS No. | 1231952-70-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H9N3O4S |
| Molecular Weight | 315.304 |
| Exact Mass | 315.031 |
| XLogP3 | 3.5763 |
| Mr | 82.9525 |
| PSA | 126.14 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 33 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cnc2c(c1)nc(s2)c1ccccc1[N+](=O)[O-] |
