Base information
| Cat. No. | |
| CAS No. | 172733-42-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H21N2NaO5 |
| Molecular Weight | 404.392 |
| Exact Mass | 404.135 |
| XLogP3 | 3.1962 |
| Mr | 104.745 |
| PSA | 111.62 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 51 |
| Ring number | 3 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CCc1c(C(=O)C(=O)N)c2c(n1Cc1ccccc1)cccc2OCC(=O)O.[NaH] |
