Base information
| Cat. No. | |
| CAS No. | 119615-63-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H11ClN4O |
| Molecular Weight | 286.716 |
| Exact Mass | 286.062 |
| XLogP3 | 2.67168 |
| Mr | 77.8947 |
| PSA | 73.95 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cc(c([nH]c1=O)C)c1ccc2n(c1)ccn2.Cl |
