Base information
| Cat. No. | |
| CAS No. | 1217512-44-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H21NO4S |
| Molecular Weight | 383.461 |
| Exact Mass | 383.119 |
| XLogP3 | 4.1115 |
| Mr | 109.079 |
| PSA | 92.14 |
| Sequence | - |
| Atom number | 48 |
| Bond number | 51 |
| Ring number | 4 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCC1SC[C@@H](N1C(=O)OCC1c2ccccc2-c2c1cccc2)C(=O)O |
