HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-(4-Chloroanilino)-4-(4-pyridylmethylamino)phthalazine

Identifiers & Physical Properties
| Molecular formula | C20H16ClN5 |
|---|---|
| Average molar mass | 361.8 g/mol |
| SMILES | Clc1ccc(Nc2nnc(NCc3ccncc3)c3ccccc23)cc1 |
| InChIKey | HXPCKJPCDLSTDD-UHFFFAOYSA-N |
| PubChem CID | 6326421 |
| ChEMBL | CHEMBL74034 |
Chemical & Physical Properties
| XLogP | 4.3 |
|---|---|
| Topological polar surface area | 62.7 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 5 |
| Heavy atoms | 26 |
| Formal charge | 0 |
| Complexity | 422 |