Base information
| Cat. No. | |
| CAS No. | 1187595-84-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H20N7O6PS |
| Molecular Weight | 469.412 |
| Exact Mass | 469.093 |
| XLogP3 | 1.18578 |
| Mr | 112.77 |
| PSA | 216.51 |
| Sequence | - |
| Atom number | 51 |
| Bond number | 53 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OP(=O)(O)O.N#CCC1(CN(C1)S(=O)(=O)CC)n1ncc(c1)c1ncnc2c1cc[nH]2 |
