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化合物简介
GW501516 (also known as GW-501,516, GW1516, GSK-516 and on the black market as Endurobol) is a PPARδ receptor agonist that was invented in a collaboration between Ligand Pharmaceuticals and GlaxoSmithKline in the 1990s, was entered into clinical development as a drug candidate for metabolic diseases and cardiovascular diseases, and was abandoned in 2007 because animal testing showed that the drug caused cancer to develop rapidly in several organs.
基本信息
CAS:317318-70-0
中文别名:2-(4-((2-(4-(三氟甲基)苯基)-5-甲基噻唑-4-基)甲基硫基)-2-甲基苯氧基)乙酸;
英文别名:2-methyl-4-(((4-methyl-2-(4-(trifluoromethyl)phenyl)-5-(thiazolyl)methyl)thio)phenoxy)acetic acid;Endurobol;2-(2-BROMOPHENYL)-3\'-TRIFLUOROMETHYLACETOPHENONE;{2-Methyl-4-{{4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl}methylthio}phenoxy}acetic acid;GW1516;2-(4-((2-(4-(Trifluoromethyl)phenyl)-5-methylthiazol-4-yl)methylthio)-2-methylphenoxy)acetic acid;UNII-7I2HA1NU22;GW 501516;2-[2-methyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenoxy]acetic acid;
分子式:C21H18F3NO3S2
分子量:453.498
精确质量:453.068
Psa:112.96
Logp:6.2014
中文别名:2-(4-((2-(4-(三氟甲基)苯基)-5-甲基噻唑-4-基)甲基硫基)-2-甲基苯氧基)乙酸;
英文别名:2-methyl-4-(((4-methyl-2-(4-(trifluoromethyl)phenyl)-5-(thiazolyl)methyl)thio)phenoxy)acetic acid;Endurobol;2-(2-BROMOPHENYL)-3\'-TRIFLUOROMETHYLACETOPHENONE;{2-Methyl-4-{{4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl}methylthio}phenoxy}acetic acid;GW1516;2-(4-((2-(4-(Trifluoromethyl)phenyl)-5-methylthiazol-4-yl)methylthio)-2-methylphenoxy)acetic acid;UNII-7I2HA1NU22;GW 501516;2-[2-methyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenoxy]acetic acid;
分子式:C21H18F3NO3S2
分子量:453.498
精确质量:453.068
Psa:112.96
Logp:6.2014
编号系统
MDL号:MFCD09033000
物化性质
外观与性状:白色固体
密度:1.426 g/cm3
沸点:584.543ºC at 760 mmHg
闪点:307.321ºC
折射率:1.619
密度:1.426 g/cm3
沸点:584.543ºC at 760 mmHg
闪点:307.321ºC
折射率:1.619
安全信息
生产方法及用途
合成路线
上游原料
下游产品
图谱
1H NMR : Predict

13C NMR : Predict
