Base information
| Cat. No. | |
| CAS No. | 1374639-76-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H14ClN3O |
| Molecular Weight | 251.712 |
| Exact Mass | 251.083 |
| XLogP3 | 1.9013 |
| Mr | 67.3655 |
| PSA | 58.04 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OCC#Cc1cnc(nc1NC1CCCC1)Cl |
