Base information
| Cat. No. | |
| CAS No. | 196489-27-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H19N3O4S |
| Molecular Weight | 361.415 |
| Exact Mass | 361.11 |
| XLogP3 | 2.9493 |
| Mr | 94.861 |
| PSA | 116.54 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 46 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | COc1c(CO)cnc(c1C)C[S@](=O)c1nc2c([nH]1)cc(cc2)OC |
