Base information
| Cat. No. | |
| CAS No. | 1227675-50-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H22ClN5 |
| Molecular Weight | 331.843 |
| Exact Mass | 331.156 |
| XLogP3 | 3.9004 |
| Mr | 98.8118 |
| PSA | 81.06 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 47 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N[C@@H]1CCN(C1)c1nc(N)nc2-c3ccccc3CCCc12.Cl |
