Base information
| Cat. No. | |
| CAS No. | 1286218-64-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H22N8O11P2S4 |
| Molecular Weight | 764.665 |
| Exact Mass | 763.977 |
| XLogP3 | 0.4038 |
| Mr | 172.783 |
| PSA | 396.47 |
| Sequence | - |
| Atom number | 69 |
| Bond number | 73 |
| Ring number | 5 |
| Rotor number | 14 |
| Residues number | 0 |
| Canonical smiles | CCO/N=C(\C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)[O-])Sc1scc(n1)c1cc[n+](cc1)C)/c1nsc(n1)NP(=O)(OP(=O)(O)O)O |
