Base information
| Cat. No. | |
| CAS No. | 1255099-52-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6ClN3S |
| Molecular Weight | 211.671 |
| Exact Mass | 210.997 |
| XLogP3 | 2.4001 |
| Mr | 54.064 |
| PSA | 63.97 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CSc1nc2ccnc(c2cn1)Cl |