Base information
| Cat. No. | |
| CAS No. | 80681-58-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H21N5O7S |
| Molecular Weight | 439.443 |
| Exact Mass | 439.116 |
| XLogP3 | 1.0355 |
| Mr | 103.606 |
| PSA | 183.05 |
| Sequence | - |
| Atom number | 51 |
| Bond number | 53 |
| Ring number | 3 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | CSc1nc(N)nc2c1ncn2[C@@H]1O[C@@H]([C@H]([C@H]1OC(=O)C)OC(=O)C)COC(=O)C |
