Base information
| Cat. No. | |
| CAS No. | 1345982-69-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C28H38N2O7S |
| Molecular Weight | 546.676 |
| Exact Mass | 546.24 |
| XLogP3 | 5.7086 |
| Mr | 149.117 |
| PSA | 150.41 |
| Sequence | - |
| Atom number | 76 |
| Bond number | 78 |
| Ring number | 3 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | CCCC[C@@]1(CC)N[C@H](c2ccccc2)c2c(S(=O)(=O)C1)cc(c(c2)OC)CNC(CC(=O)O)CC(=O)O |
