Base information
| Cat. No. | |
| CAS No. | 129872-84-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6ClN3O |
| Molecular Weight | 183.595 |
| Exact Mass | 183.02 |
| XLogP3 | 0.915 |
| Mr | 46.6257 |
| PSA | 50.68 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Clc1nc2ccn(c2c(=O)[nH]1)C |
