Base information
| Cat. No. | |
| CAS No. | 1469337-91-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H21ClIN3O4S |
| Molecular Weight | 513.778 |
| Exact Mass | 512.999 |
| XLogP3 | 3.9016 |
| Mr | 114.611 |
| PSA | 96.12 |
| Sequence | - |
| Atom number | 47 |
| Bond number | 48 |
| Ring number | 2 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | COc1cc(Cl)c(cc1NCC(=O)N1CCC(CC1)NS(=O)(=O)C=C)I |
