Base information
| Cat. No. | |
| CAS No. | 115956-13-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H26N2O7S |
| Molecular Weight | 438.495 |
| Exact Mass | 438.146 |
| XLogP3 | 2.9774 |
| Mr | 114.015 |
| PSA | 134.38 |
| Sequence | - |
| Atom number | 56 |
| Bond number | 58 |
| Ring number | 5 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CS(=O)(=O)O.O=C1CN2[C@@H]3C[C@H]1C[C@H]2C[C@H](C3)OC(=O)c1c[nH]c2c1cccc2.O |
