Base information
| Cat. No. | |
| CAS No. | 849946-67-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H25N3O6S |
| Molecular Weight | 399.462 |
| Exact Mass | 399.146 |
| XLogP3 | 4.4254 |
| Mr | 105.586 |
| PSA | 143.9 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 53 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | O=C(N1CCC(CC1)(N)c1ccc(cc1[N+](=O)[O-])S(=O)(=O)C)OC(C)(C)C |
