Base information
| Cat. No. | |
| CAS No. | 209784-80-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H21ClN4O3 |
| Molecular Weight | 412.869 |
| Exact Mass | 412.13 |
| XLogP3 | 5.1896 |
| Mr | 113.363 |
| PSA | 106.34 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 51 |
| Ring number | 3 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | O=C(OCc1cccnc1)NCc1ccc(cc1)C(=O)Nc1ccccc1N.Cl |
