Base information
| Cat. No. | |
| CAS No. | 115687-05-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H17ClN4O3 |
| Molecular Weight | 396.827 |
| Exact Mass | 396.099 |
| XLogP3 | 4.2849 |
| Mr | 116.743 |
| PSA | 82.26 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 48 |
| Ring number | 4 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c2c1cccn2)[N+](=O)[O-] |
