Nexavar;Sorafenib Tosylate, -Drug Synthesis Database

【结构式】

【药物名称】Nexavar;Sorafenib Tosylate

【化学名称】4-[4-[3-[4-Chloro-3-(trifluoromethyl) phenyl]ureido]phenoxy]-N²-methylpyridine-2-carboxamide 4-methylbenzensulfonate

【CA登记号】475207-59-1

【分子式】C₂₁H₁₆ClF₃N₄O₃.C₇H₆O₃S

【分子量】637.03

【开发单位】Bayer Pharmceuticals Corp.

【药理作用】Anti tumor

【1】 Wilhelm S. 2007. Use of sorafenib for the treatment of cancers having resisunce to chemotherapeutic agents. W0 2007059155
【2】 Bankston D, Dumas J, Natero R, et al. 2002. A scaleable synthesis of BAY 43-9006: a potent raf kinase inhibitor for the treatment of cancer. Org Proc Dev, 6(6):777～781
【3】 Logers M, Gehring R, Kuhn O, et al. 2006. Process for the preparation of 4-[4-[[[[4-chloro-3-(trifluoromethyl) phenyl]amino]carbonyl]amino]phenoxy]-N-methylpyridine-2-carboxamide and its tosylate salt. WO 2006034796

中间体序号	中间体编号	品名	CAS号	分子式	供应商	用于合成
(I)	29950	2-pyridinecarboxylic acid；picolinic acid;Pyridine-2-carboxylic acid	98-98-6	C₆H₅NO₂	详情	详情
(II)	49908	4-chloropyridine-2-carbonyl chloride hydrochloride;(4-Chloro-2-pyridinecarbonyl Chloride Hydrochloride);4-Chloro-2-pyridinecarbonyl Chloride Hydrochlorid	51727-15-2	C₆H₃Cl₂NO.HCl	详情	详情
(III)	49910	4-chloro-N-methyl-2-pyridinecarboxamide；4-chloro-N-methylpyridine-2-carboxamide;4-chloro-N-methylpicolinamide;4-Chloro-N-methylpicolinamide;2-(N-Methylcarbamoyl)-4-chloropyridine;4-Chloropyridine-2-carboxylicacid methylamide;N-Methyl-4-chloro-2-pyridinecarboxamide;N-Methyl-4-chloropicolinamide	220000-87-3	C₇H₇ClN₂O	详情	详情
(IV)	15715	4-Aminophenol	123-30-8	C₆H₇NO	详情	详情
(V)	49912	4-(4-aminophenoxy)-N-methyl-2-pyridinecarboxamide	284462-37-9	C₁₃H₁₃N₃O₂	详情	详情
(VI)	37868	1-chloro-4-isocyanato-2-(trifluoromethyl)benzene; 4-chloro-3-(trifluoromethyl)phenyl isocyanate	327-78-6	C₈H₃ClF₃NO	详情	详情
(VII)	66747	4-[4-[3-[4-Chloro-3-(trifluoromethyl)phenyl]ureido]phenoxy]-N-methylpyridine-2-carboxamide	284461-73-0	C₂₁H₁₆ClF₃N₄O₃	详情	详情

【1】 Wilhelm S. 2007. Use of sorafenib for the treatment of cancers having resisunce to chemotherapeutic agents. W0 2007059155
【2】 Bankston D, Dumas J, Natero R, et al. 2002. A scaleable synthesis of BAY 43-9006: a potent raf kinase inhibitor for the treatment of cancer. Org Proc Dev, 6(6):777～781
【3】 Logers M, Gehring R, Kuhn O, et al. 2006. Process for the preparation of 4-[4-[[[[4-chloro-3-(trifluoromethyl) phenyl]amino]carbonyl]amino]phenoxy]-N-methylpyridine-2-carboxamide and its tosylate salt. WO 2006034796

中间体序号	中间体编号	品名	CAS号	分子式	供应商	用于合成
(I)	51494	4-Chloro-3-trifluoromethylaniline; 4-Chloro-alpha,alpha,alpha-trifluoro-m-toluidine; 5-Amino-2-chlorobenzotrifluoride; 2-Chloro-5-aminobenzotrifluoride; 2-Amino-5-chlorotrifluoromethylbenzene	320-51-4	C₇H₅ClF₃N	详情	详情
(II)	11353	1,1'-Carbonyldiimidazole; Di(1H-imidazol-1-yl)methanone; N,N-Carbonyldiimidazole; 1,1'-Carbonylbis(1H-imidazole)	530-62-1	C₇H₆N₄O	详情	详情
(III)	49912	4-(4-aminophenoxy)-N-methyl-2-pyridinecarboxamide	284462-37-9	C₁₃H₁₃N₃O₂	详情	详情
(IV)	66747	4-[4-[3-[4-Chloro-3-(trifluoromethyl)phenyl]ureido]phenoxy]-N-methylpyridine-2-carboxamide	284461-73-0	C₂₁H₁₆ClF₃N₄O₃	详情	详情

Extended Information