Base information
| Cat. No. | |
| CAS No. | 1269054-63-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8ClN3S |
| Molecular Weight | 213.687 |
| Exact Mass | 213.013 |
| XLogP3 | 3.1705 |
| Mr | 56.7144 |
| PSA | 80.04 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Nc1cnc(s1)c1cccnc1.Cl |
