Base information
| Cat. No. | |
| CAS No. | 216570-81-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C27H27NO3S |
| Molecular Weight | 445.573 |
| Exact Mass | 445.171 |
| XLogP3 | 6.4491 |
| Mr | 136.774 |
| PSA | 81.17 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 63 |
| Ring number | 5 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | Oc1ccc(cc1)c1sc2c(c1c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O |
