Base information
| Cat. No. | |
| CAS No. | 1005775-56-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H22ClN5O |
| Molecular Weight | 395.885 |
| Exact Mass | 395.151 |
| XLogP3 | 4.9448 |
| Mr | 112.763 |
| PSA | 64.22 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 52 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | O=C(c1ccc(cc1)C(C)(C)C)Nc1cn2c(n1)ccc(c2)n1cncc1.Cl |
