HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethyl 2-[[6-[(3-ethoxycarbonyl-4,5-dimethylthiophen-2-yl)amino]-2,2,3,3,4,4,5,5-octafluoro-6-oxohexanoyl]amino]-4,5-dimethylthiophene-3-carboxylate
ethyl 2-[(6-{[3-(ethoxycarbonyl)-4,5-dimethyl-2-thienyl]amino}-2,2,3,3,4,4,5,5-octafluoro-6-oxohexanoyl)amino]-4,5-dimethyl-3-thiophenecarboxylate
![Ethyl 2-[[6-[(3-ethoxycarbonyl-4,5-dimethylthiophen-2-yl)amino]-2,2,3,3,4,4,5,5-octafluoro-6-oxohexanoyl]amino]-4,5-dimethylthiophene-3-carboxylate molecular structure](/img/chemical/178819811.png)
Identifiers & Physical Properties
| CAS No. | 362592-12-9 |
|---|---|
| Molecular formula | C24H24F8N2O6S2 |
| Average molar mass | 652.6 g/mol |
| SMILES | CCOC(=O)c1c(NC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)Nc2sc(C)c(C)c2C(=O)OCC)sc(C)c1C |
| InChIKey | YXQTYTGEYVVSQS-UHFFFAOYSA-N |
Chemical & Physical Properties
| XLogP | 7.8 |
|---|---|
| Topological polar surface area | 167 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 16 |
| Rotatable bonds | 13 |
| Heavy atoms | 42 |
| Formal charge | 0 |
| Complexity | 972 |