Base information
| Cat. No. | |
| CAS No. | 745046-84-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H21N3O7S |
| Molecular Weight | 447.462 |
| Exact Mass | 447.11 |
| XLogP3 | 1.6798 |
| Mr | 115.991 |
| PSA | 131.56 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 55 |
| Ring number | 4 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CC(=O)OCCN1C(=O)c2c(C1=O)c1cc(ccc1nc2C)S(=O)(=O)N1CCOCC1 |
