Base information
| Cat. No. | |
| CAS No. | 77549-14-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H17NO3S |
| Molecular Weight | 267.344 |
| Exact Mass | 267.093 |
| XLogP3 | 1.9884 |
| Mr | 72.1277 |
| PSA | 80.7 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 35 |
| Ring number | 1 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | COC(=O)[C@@H](NC(=O)C)CSCc1ccccc1 |
