Base information
| Cat. No. | |
| CAS No. | 1189727-33-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5ClN4 |
| Molecular Weight | 168.584 |
| Exact Mass | 168.02 |
| XLogP3 | 1.7747 |
| Mr | 43.3031 |
| PSA | 67.59 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 17 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Clc1cncc2c1c(N)n[nH]2 |
