Base information
| Cat. No. | |
| CAS No. | 105704-31-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H14ClN5O |
| Molecular Weight | 279.725 |
| Exact Mass | 279.089 |
| XLogP3 | 2.9891 |
| Mr | 74.8361 |
| PSA | 85.95 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 34 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCOc1ccc(cc1)Nc1nc(N)nc(n1)CCl |
