Base information
| Cat. No. | |
| CAS No. | 223920-67-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H19N3O7S2 |
| Molecular Weight | 489.521 |
| Exact Mass | 489.066 |
| XLogP3 | 4.0525 |
| Mr | 130.71 |
| PSA | 189.6 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 55 |
| Ring number | 4 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | COc1cc(C(OC(=O)[C@H]2CSC(=N2)c2nc3c(s2)cc(cc3)O)C)c(cc1OC)[N+](=O)[O-] |
