Base information
| Cat. No. | |
| CAS No. | 55115-80-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H4ClN3S |
| Molecular Weight | 221.666 |
| Exact Mass | 220.981 |
| XLogP3 | 2.8929 |
| Mr | 57.726 |
| PSA | 66.91 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 20 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Clc1ncnc2c1sc1c2cccn1 |
