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Dopropidil hydrochloride, Org-30701, CERM-4205

吡咯利定,1-[[(2-甲基丙氧基)甲基]-2-[[[1-(1-丙烯-1-基)环己基]羟基]-盐酸盐(1:1) 多普吡地 Chemical Name: 1-[1-(Isobutoxymethyl)-2-[[1-(1-propynyl)cyclohexyl]oxy]ethyl]pyrrolidine hydrochloride; 1-[1-[(2-Methylpropoxyl)methyl]-2-[[1-(1-propynyl)cyclohexyl]oxy]ethyl]pyrrolidine hydrochloride
CAS No. 117241-47-1, 79700-61-1 (free base)
项目整合开发状态: Phase II
项目研究机构: Riom (Originator)
合成路线:This compound can be obtained in a simple way:Under nitrogen,borontrifluoride etherate solution is added to heated 2-methyl-1-propanol (II),and 1-chloro-2,3-epoxypropane (I) is added.When the reaction is completed,pyrrolidine (IV) is added to obtain alpha-[2-methyl-propoxymethyl]-1-pyrrolidine-ethanol (V).1-[2-Chloro-3-(2-methylpropoxy)propyl]pyrrolidine (VI) is obtained by chlorination with thionyl chloride of the subsequent amino alcohol.The condensation of 1-propynyl-1-cyclohexanol (VII) with 1-[2-chloro-3-(2-methylpropoxy)propyl]pyrrolidine (VI) in toluene and sodium hydroxide in water affords dopropidil.Due to the pyrrolidine shift mechanism,the reaction yields the correct structure,confirmed by 1H and 13C NMR as well as by mass spectra and X-ray analysis.The pyrrolidine shift mechanism is explained by the assumption of an intermediate aziridinium ion (VIII),which is opened regiospecifically at the less hindered C-N bond by the nucleophile ion.
📌 参考资料/链接:
参考文献标题:Ethers of 1-(2-propynyloxy)-2-amino-3-propanol,their preparation and their application in therapeutic
文献作者:Carlier,P.; Montell,A.J.-C.; Simond,J.A.L.(Riom Laboratoires)
参考来源:EP 0031771; US 4430332

📄 详细内容


合成路线:This compound can be obtained in a simple way:Under nitrogen,borontrifluoride etherate solution is added to heated 2-methyl-1-propanol (II),and 1-chloro-2,3-epoxypropane (I) is added.When the reaction is completed,pyrrolidine (IV) is added to obtain alpha-[2-methyl-propoxymethyl]-1-pyrrolidine-ethanol (V).1-[2-Chloro-3-(2-methylpropoxy)propyl]pyrrolidine (VI) is obtained by chlorination with thionyl chloride of the subsequent amino alcohol.The condensation of 1-propynyl-1-cyclohexanol (VII) with 1-[2-chloro-3-(2-methylpropoxy)propyl]pyrrolidine (VI) in toluene and sodium hydroxide in water affords dopropidil.Due to the pyrrolidine shift mechanism,the reaction yields the correct structure,confirmed by 1H and 13C NMR as well as by mass spectra and X-ray analysis.The pyrrolidine shift mechanism is explained by the assumption of an intermediate aziridinium ion (VIII),which is opened regiospecifically at the less hindered C-N bond by the nucleophile ion.

参考文献标题:X-ray analysis of CERM 4205
文献作者:Dupont,L.; Dideberg,O.; Simond,J.
参考来源:Acta Cryst Sect C 1986,42864


合成路线:This compound can be obtained in a simple way:Under nitrogen,borontrifluoride etherate solution is added to heated 2-methyl-1-propanol (II),and 1-chloro-2,3-epoxypropane (I) is added.When the reaction is completed,pyrrolidine (IV) is added to obtain alpha-[2-methyl-propoxymethyl]-1-pyrrolidine-ethanol (V).1-[2-Chloro-3-(2-methylpropoxy)propyl]pyrrolidine (VI) is obtained by chlorination with thionyl chloride of the subsequent amino alcohol.The condensation of 1-propynyl-1-cyclohexanol (VII) with 1-[2-chloro-3-(2-methylpropoxy)propyl]pyrrolidine (VI) in toluene and sodium hydroxide in water affords dopropidil.Due to the pyrrolidine shift mechanism,the reaction yields the correct structure,confirmed by 1H and 13C NMR as well as by mass spectra and X-ray analysis.The pyrrolidine shift mechanism is explained by the assumption of an intermediate aziridinium ion (VIII),which is opened regiospecifically at the less hindered C-N bond by the nucleophile ion.
参考文献标题:DOPROPIDIL HYDROCHLORIDE
文献作者:Massingham,R.; Monteil,A.
参考来源:Drugs Fut 1990,15(5),453


产品链接: CAS No. 117241-47-1››

产品链接: CAS No.79700-61-1››