Base information
| Cat. No. | |
| CAS No. | 2089044-02-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C114H114F4N4O4S4 |
| Molecular Weight | 1808.4 |
| Exact Mass | 1806.77 |
| XLogP3 | 32.3921 |
| Mr | 533.339 |
| PSA | 260.72 |
| Sequence | - |
| Atom number | 244 |
| Bond number | 258 |
| Ring number | 15 |
| Rotor number | 42 |
| Residues number | 0 |
| Canonical smiles | CCCCCCc1ccc(cc1)C1(c2ccc(cc2)CCCCCC)c2cc3-c4sc(cc4C(c3cc2-c2c1cc(s2)c1sc(cc1OCC(CCCC)CC)/C=C\1/C(=C(C#N)C#N)c2c(C1=O)cc(c(c2)F)F)(c1ccc(cc1)CCCCCC)c1ccc(cc1)CCCCCC)c1sc(cc1OCC(CCCC)CC)/C=C\1/C(=C(C#N)C#N)c2c(C1=O)cc(c(c2)F)F |
