Base information
| Cat. No. | |
| CAS No. | 107807-39-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5N3O2S |
| Molecular Weight | 219.22 |
| Exact Mass | 219.01 |
| XLogP3 | 1.363 |
| Mr | 59.0727 |
| PSA | 110.43 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | S=C=Nc1ccc2c(c1)c(O)n[nH]c2=O |
