Base information
| Cat. No. | |
| CAS No. | 1069094-65-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H24N3NaO3S2 |
| Molecular Weight | 453.553 |
| Exact Mass | 453.116 |
| XLogP3 | 5.2972 |
| Mr | 120.042 |
| PSA | 147.8 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 55 |
| Ring number | 3 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | CCCCc1ccccc1NCc1ccc(s1)C(=O)Nc1scc(n1)CC(=O)O.[NaH] |
