Base information
| Cat. No. | |
| CAS No. | 1016543-77-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H19N5O4S |
| Molecular Weight | 437.472 |
| Exact Mass | 437.116 |
| XLogP3 | 3.811 |
| Mr | 116.222 |
| PSA | 142.62 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 53 |
| Ring number | 4 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | COc1cc(cc(c1OC)OC)C(=O)c1ccc(cc1n1cncn1)c1csc(n1)N |
