Base information
| Cat. No. | |
| CAS No. | 21278-86-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6N2O2S |
| Molecular Weight | 206.221 |
| Exact Mass | 206.015 |
| XLogP3 | 1.9033 |
| Mr | 52.3043 |
| PSA | 91.32 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1csc(n1)c1ccncc1 |
