Base information
| Cat. No. | |
| CAS No. | 77628-51-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6N2O2S |
| Molecular Weight | 182.2 |
| Exact Mass | 182.015 |
| XLogP3 | 1.4024 |
| Mr | 44.9943 |
| PSA | 82.84 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Cc1nc2n(c1C(=O)O)ccs2 |
