Base information
| Cat. No. | |
| CAS No. | 856307-27-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H16ClN3O |
| Molecular Weight | 253.728 |
| Exact Mass | 253.098 |
| XLogP3 | 2.4011 |
| Mr | 72.5277 |
| PSA | 38.96 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 33 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CNc1c(C)n(n(c1=O)c1ccccc1)C.Cl |
