Base information
| Cat. No. | |
| CAS No. | 158966-92-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C35H36ClNO3S |
| Molecular Weight | 586.183 |
| Exact Mass | 585.21 |
| XLogP3 | 8.948 |
| Mr | 172.646 |
| PSA | 95.72 |
| Sequence | - |
| Atom number | 77 |
| Bond number | 81 |
| Ring number | 5 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CC1(CS[C@@H](c2cccc(c2)/C=C/c2ccc3c(n2)cc(cc3)Cl)CCc2ccccc2C(O)(C)C)CC1 |
