Base information
| Cat. No. | |
| CAS No. | 3895-92-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H18ClNO4 |
| Molecular Weight | 383.825 |
| Exact Mass | 383.092 |
| XLogP3 | 0.7206 |
| Mr | 107.451 |
| PSA | 40.8 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 48 |
| Ring number | 5 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1c(OC)ccc2c1c[n+](C)c1c2ccc2c1cc1OCOc1c2.[Cl-] |
