Base information
| Cat. No. | |
| CAS No. | 1013750-77-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H20N4O4S |
| Molecular Weight | 412.462 |
| Exact Mass | 412.121 |
| XLogP3 | 2.7732 |
| Mr | 113.793 |
| PSA | 105.29 |
| Sequence | - |
| Atom number | 49 |
| Bond number | 52 |
| Ring number | 4 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(c(c1)c1nnc2n1N=C(CS2)c1ccc(c(c1)OC)OC)OC |
