Base information
| Cat. No. | |
| CAS No. | 5464-79-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8N2OS |
| Molecular Weight | 180.227 |
| Exact Mass | 180.036 |
| XLogP3 | 2.4683 |
| Mr | 50.5164 |
| PSA | 76.38 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1cccc2c1nc(s2)N |
