Base information
| Cat. No. | |
| CAS No. | 205170-72-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H6N2O4S3 |
| Molecular Weight | 338.382 |
| Exact Mass | 337.949 |
| XLogP3 | 6.0679 |
| Mr | 88.589 |
| PSA | 176.36 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 29 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1c(sc(c1[N+](=O)[O-])c1cccs1)c1cccs1 |
