Base information
| Cat. No. | |
| CAS No. | 129731-10-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H13ClN6 |
| Molecular Weight | 324.768 |
| Exact Mass | 324.089 |
| XLogP3 | 2.8509 |
| Mr | 87.616 |
| PSA | 61.42 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 39 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc(cc1)[C@@H](c1ccc2c(c1)n(C)nn2)n1ncnc1 |
