HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-2,4-dioxo-1-imidazolidineacetonitrile
RU58642 · RU-58642 · RU 58642 · 1-Imidazolidineacetonitrile, 3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-2,4-dioxo-

Identifiers & Physical Properties
| CAS No. | 143782-63-2 |
|---|---|
| Molecular formula | C15H11F3N4O2 |
| Average molar mass | 336.27 g/mol |
| Monoisotopic mass | 336.08341009 g/mol |
| SMILES | CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=O)N1CC#N |
| InChIKey | ZVWXHSNUBLIKJH-UHFFFAOYSA-N |
| PubChem CID | 9840708 |
| DTXSID | DTXSID50162546 |
Chemical & Physical Properties
| XLogP | 1.9 |
|---|---|
| Topological polar surface area | 88.2 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 7 |
| Rotatable bonds | 2 |
| Heavy atoms | 24 |
| Formal charge | 0 |
| Complexity | 655 |
| Boiling point | 472.7±55.0 °C(Predicted) |
| Density | 1.47±0.1 g/cm3(Predicted) |
| pKa (acidity coefficient) | -2.42±0.40(Predicted) |
| FDA UNII | DX44GS85HK |
Applications & Uses
Uses
RU 58642 is an orally active non-steroidal antiandrogen, which displays a strong and selective affinity for androgen receptor[1].