Base information
| Cat. No. | |
| CAS No. | 854476-92-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H2ClN3S |
| Molecular Weight | 171.607 |
| Exact Mass | 170.966 |
| XLogP3 | 1.70318 |
| Mr | 38.512 |
| PSA | 74.87 |
| Sequence | - |
| Atom number | 12 |
| Bond number | 12 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Clc1nc(SC#N)ccn1 |
