Base information
| Cat. No. | |
| CAS No. | 75007-70-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H20N6O7S |
| Molecular Weight | 476.463 |
| Exact Mass | 476.111 |
| XLogP3 | -0.4246 |
| Mr | 114.67 |
| PSA | 194.3 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 56 |
| Ring number | 4 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | CO[C@@]1(NC(=O)Cc2ccc(cc2)O)C(=O)N2[C@@H]1OCC(=C2C(=O)O)CSc1nnnn1C |
