Base information
| Cat. No. | |
| CAS No. | 2304444-49-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C82H86F4N8O2S5 |
| Molecular Weight | 1451.93 |
| Exact Mass | 1450.54 |
| XLogP3 | 25.7566 |
| Mr | 419.456 |
| PSA | 306.14 |
| Sequence | - |
| Atom number | 187 |
| Bond number | 198 |
| Ring number | 12 |
| Rotor number | 34 |
| Residues number | 0 |
| Canonical smiles | CCCCCCCCCCCc1c(C=C2C(=C(C#N)C#N)c3c(C2=O)cc(c(c3)F)F)sc2c1sc1c2n(c2c1c1nsnc1c1c2n(CC(CCCC)CC)c2c1sc1c2sc(c1CCCCCCCCCCC)C=C1C(=C(C#N)C#N)c2c(C1=O)cc(c(c2)F)F)CC(CCCC)CC |
