Base information
| Cat. No. | |
| CAS No. | 1589503-98-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H8ClN3O |
| Molecular Weight | 161.59 |
| Exact Mass | 161.036 |
| XLogP3 | 1.4506 |
| Mr | 39.8934 |
| PSA | 61.03 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(nn1)N.Cl |
