Base information
| Cat. No. | |
| CAS No. | 81136-42-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7ClN2S |
| Molecular Weight | 198.673 |
| Exact Mass | 198.002 |
| XLogP3 | 2.9071 |
| Mr | 52.198 |
| PSA | 54.02 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CCc1sc2c(c1)c(Cl)ncn2 |
