Base information
| Cat. No. | |
| CAS No. | 1206880-66-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C40H44N4O5S |
| Molecular Weight | 692.866 |
| Exact Mass | 692.303 |
| XLogP3 | 8.1207 |
| Mr | 202.912 |
| PSA | 132.08 |
| Sequence | - |
| Atom number | 94 |
| Bond number | 99 |
| Ring number | 6 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | COc1cnc(nc1)c1ccc(cc1)Cn1c2ccc(cc2c(c1CC(C(=O)O)(C)C)SC(C)(C)C)OC[C@@H]1Cc2c(N1C(=O)C)cccc2 |
