Base information
| Cat. No. | |
| CAS No. | 848952-83-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H5ClN4O |
| Molecular Weight | 172.572 |
| Exact Mass | 172.015 |
| XLogP3 | 0.8247 |
| Mr | 37.9386 |
| PSA | 80.9 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NNC(=O)c1cnc(cn1)Cl |
