Base information
| Cat. No. | |
| CAS No. | 185808-79-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11NO5S |
| Molecular Weight | 281.284 |
| Exact Mass | 281.036 |
| XLogP3 | 1.6163 |
| Mr | 72.263 |
| PSA | 118 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1C(=O)O)CC1SC(=O)NC1=O |
