Base information
| Cat. No. | |
| CAS No. | 87628-50-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H14ClN3 |
| Molecular Weight | 235.713 |
| Exact Mass | 235.088 |
| XLogP3 | 2.8532 |
| Mr | 70.3304 |
| PSA | 40.71 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | c1ccc(cc1)c1n[nH]c2c1CNCC2.Cl |
