Base information
| Cat. No. | |
| CAS No. | 5407-57-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H12ClN3 |
| Molecular Weight | 221.686 |
| Exact Mass | 221.072 |
| XLogP3 | 3.0321 |
| Mr | 63.5731 |
| PSA | 50.94 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | NCCNc1ccnc2c1ccc(c2)Cl |
