Base information
| Cat. No. | |
| CAS No. | 53994-69-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7ClN2O3S |
| Molecular Weight | 234.66 |
| Exact Mass | 233.987 |
| XLogP3 | 0.402 |
| Mr | 54.9382 |
| PSA | 108.93 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1[C@@H](N)[C@@H]2N1C(=C(CS2)Cl)C(=O)O |
