Base information
| Cat. No. | |
| CAS No. | 101831-37-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H9Cl3N4O2 |
| Molecular Weight | 407.638 |
| Exact Mass | 405.979 |
| XLogP3 | 3.53648 |
| Mr | 99.4937 |
| PSA | 91.54 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 37 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | N#CC(c1c(Cl)cc(cc1Cl)n1ncc(=O)[nH]c1=O)c1ccc(cc1)Cl |
