Base information
| Cat. No. | |
| CAS No. | 3598-37-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C23H26N2O5S |
| Molecular Weight | 442.528 |
| Exact Mass | 442.156 |
| XLogP3 | 4.2204 |
| Mr | 124.675 |
| PSA | 123.45 |
| Sequence | - |
| Atom number | 57 |
| Bond number | 58 |
| Ring number | 3 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | OC(=O)/C=C\C(=O)O.CN(CCCN1c2ccccc2Sc2c1cc(cc2)C(=O)C)C |
