Base information
| Cat. No. | |
| CAS No. | 2095504-33-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C90H82N4O2S2 |
| Molecular Weight | 1315.77 |
| Exact Mass | 1314.59 |
| XLogP3 | 23.1883 |
| Mr | 406.599 |
| PSA | 185.78 |
| Sequence | - |
| Atom number | 180 |
| Bond number | 192 |
| Ring number | 13 |
| Rotor number | 26 |
| Residues number | 0 |
| Canonical smiles | CCCCCCc1ccc(cc1)C1(c2ccc(cc2)CCCCCC)c2cc(sc2-c2c1cc1-c3sc(cc3C(c1c2)(c1ccc(cc1)CCCCCC)c1ccc(cc1)CCCCCC)C=C1C(=O)c2c(C1=C(C#N)C#N)cccc2)C=C1C(=O)c2c(C1=C(C#N)C#N)cccc2 |
