Base information
| Cat. No. | |
| CAS No. | 1253791-97-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H15N3O4S |
| Molecular Weight | 357.384 |
| Exact Mass | 357.078 |
| XLogP3 | 2.3849 |
| Mr | 94.9655 |
| PSA | 119.61 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 42 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1c(O)c2cnc(nc2n(c1=O)c1ccccc1)SC |
