Base information
| Cat. No. | |
| CAS No. | 53994-83-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H12ClN3O5S |
| Molecular Weight | 369.78 |
| Exact Mass | 369.019 |
| XLogP3 | 2.4922 |
| Mr | 92.5674 |
| PSA | 143.75 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 38 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)OCc1ccc(cc1)[N+](=O)[O-])Cl |
