Base information
| Cat. No. | |
| CAS No. | 88102-88-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H20N6O6S |
| Molecular Weight | 424.432 |
| Exact Mass | 424.117 |
| XLogP3 | 2.8209 |
| Mr | 108.503 |
| PSA | 193.7 |
| Sequence | - |
| Atom number | 49 |
| Bond number | 50 |
| Ring number | 2 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | OCCN(c1cc(NC(=O)C)c(cc1OC)N=Nc1ncc(s1)[N+](=O)[O-])CCO |
