Base information
| Cat. No. | |
| CAS No. | 851627-62-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H20BrN4O12PS |
| Molecular Weight | 579.271 |
| Exact Mass | 577.972 |
| XLogP3 | 3.0377 |
| Mr | 120.508 |
| PSA | 252.3 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 53 |
| Ring number | 1 |
| Rotor number | 15 |
| Residues number | 0 |
| Canonical smiles | BrCCN(c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)NCCOP(=O)(O)O)CCOS(=O)(=O)C |
