Base information
| Cat. No. | |
| CAS No. | 853680-76-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H14ClN3O |
| Molecular Weight | 275.733 |
| Exact Mass | 275.083 |
| XLogP3 | 2.7663 |
| Mr | 78.015 |
| PSA | 38.25 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 35 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1)CN1CCc2c1ncnc2Cl |
