Base information
| Cat. No. | |
| CAS No. | 1393813-42-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H14BrClN4O2S |
| Molecular Weight | 405.698 |
| Exact Mass | 403.971 |
| XLogP3 | 4.7605 |
| Mr | 90.8634 |
| PSA | 92.36 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 37 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCCNS(=O)(=O)Nc1ncnc(c1c1ccc(cc1)Br)Cl |
