Base information
| Cat. No. | |
| CAS No. | 161716-23-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H9ClN2O |
| Molecular Weight | 256.687 |
| Exact Mass | 256.04 |
| XLogP3 | 3.0391 |
| Mr | 72.35 |
| PSA | 34.89 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 29 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc(cc1)n1ncc2c(c1=O)cccc2 |
