Base information
| Cat. No. | |
| CAS No. | 117222-10-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H8ClN3O |
| Molecular Weight | 185.611 |
| Exact Mass | 185.036 |
| XLogP3 | 1.7381 |
| Mr | 45.1096 |
| PSA | 68.01 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NNC(=O)c1ccc(nc1Cl)C |
