Base information
| Cat. No. | |
| CAS No. | 1227635-07-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H18ClN5O |
| Molecular Weight | 331.8 |
| Exact Mass | 331.12 |
| XLogP3 | 3.4938 |
| Mr | 91.8317 |
| PSA | 75.86 |
| Sequence | - |
| Atom number | 41 |
| Bond number | 43 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | Oc1ccc(cc1)CCNc1nc(Cl)nc2c1ncn2C(C)C |
