Base information
| Cat. No. | |
| CAS No. | 111079-19-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H4ClIN2S |
| Molecular Weight | 286.521 |
| Exact Mass | 285.883 |
| XLogP3 | 2.4565 |
| Mr | 51.48 |
| PSA | 51.08 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CSc1ncc(c(n1)Cl)I |
