化工社化工社 化学情報印刷レポート · 研究参考用
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 の分子構造式](/img/chemical/178819811.png)
識別子と物理属性
| CAS No. | 362592-12-9 |
|---|---|
| 分子式 | C24H24F8N2O6S2 |
| 平均分子量 | 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 |
化学・物理的性質
| XLogP | 7.8 |
|---|---|
| 極性表面積 | 167 |
| 水素結合供与体数 | 2 |
| 水素結合受容体数 | 16 |
| 回転可能結合数 | 13 |
| 重原子数 | 42 |
| 形式電荷 | 0 |
| 複雑度 | 972 |