Base information
| Cat. No. | |
| CAS No. | 111664-82-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H16ClN3O |
| Molecular Weight | 337.803 |
| Exact Mass | 337.098 |
| XLogP3 | 1.876 |
| Mr | 105.366 |
| PSA | 35.91 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 43 |
| Ring number | 5 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | CN1c2ccccc2C(=O)N2C1=C1N=c3c(=C1CC2)cccc3.Cl |
