Base information
| Cat. No. | |
| CAS No. | 1889344-13-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C86H74N4O2S8 |
| Molecular Weight | 1452.05 |
| Exact Mass | 1450.36 |
| XLogP3 | 25.8637 |
| Mr | 428.873 |
| PSA | 355.22 |
| Sequence | - |
| Atom number | 174 |
| Bond number | 188 |
| Ring number | 15 |
| Rotor number | 26 |
| Residues number | 0 |
| Canonical smiles | CCCCCCc1ccc(s1)C1(c2ccc(s2)CCCCCC)c2cc3-c4sc5c(c4C(c3cc2-c2c1c1sc(cc1s2)C=C1C(=O)c2c(C1=C(C#N)C#N)cccc2)(c1ccc(s1)CCCCCC)c1ccc(s1)CCCCCC)sc(c5)C=C1C(=O)c2c(C1=C(C#N)C#N)cccc2 |
