Base information
| Cat. No. | |
| CAS No. | 55749-30-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H10N2O2S |
| Molecular Weight | 198.242 |
| Exact Mass | 198.046 |
| XLogP3 | 1.2701 |
| Mr | 50.2638 |
| PSA | 88.38 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CSc1nc(C)cc(n1)C |
