Base information
| Cat. No. | |
| CAS No. | 125116-23-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H22ClN3O |
| Molecular Weight | 319.829 |
| Exact Mass | 319.145 |
| XLogP3 | 3.3415 |
| Mr | 88.0628 |
| PSA | 50.94 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 46 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC1(Cn2ncnc2)C(CCC1(C)C)Cc1ccc(cc1)Cl |
