Base information
| Cat. No. | |
| CAS No. | 3896-11-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H18ClN3O |
| Molecular Weight | 315.797 |
| Exact Mass | 315.114 |
| XLogP3 | 4.3854 |
| Mr | 90.134 |
| PSA | 50.94 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 42 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc2c(c1)nn(n2)c1cc(C)cc(c1O)C(C)(C)C |
