Base information
| Cat. No. | |
| CAS No. | 1189450-21-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16Cl2D20N6 |
| Molecular Weight | 387.399 |
| Exact Mass | 386.238 |
| XLogP3 | 3.8372 |
| Mr | 104.046 |
| PSA | 58.04 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 47 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Clc1nc(c2c(n1)c(nc(n2)Cl)N1C([2H])([2H])C([2H])([2H])C(C(C1([2H])[2H])([2H])[2H])([2H])[2H])N1C([2H])([2H])C([2H])([2H])C(C(C1([2H])[2H])([2H])[2H])([2H])[2H] |