Base information
| Cat. No. | |
| CAS No. | 21725-46-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H13ClN6 |
| Molecular Weight | 240.693 |
| Exact Mass | 240.089 |
| XLogP3 | 1.81688 |
| Mr | 62.4634 |
| PSA | 86.52 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 29 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCNc1nc(nc(n1)Cl)NC(C#N)(C)C |
