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(2S)-2-((4-(((2,7-二甲基-4-氧代-1,4-二氢喹唑啉-6-基)甲基)(丙-2-炔基)氨基)-2-氟苯甲酰)氨基)-4-(1H-四唑-5-基)丁酸
(1R,2S,5S)-3-[(2S)-2-[[1-(tert-butylsulfonylmethyl)cyclohexyl]carbamoylamino]-3,3-dimethylbutanoyl]-N-[(3S)-1-(cyclopropylamino)-1,2-dioxoheptan-3-yl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
化合物简介
基本信息
CAS：865466-24-6
中文别名：
英文别名：narlaprevir;CS-0445;(1R,5S)-N-[1(S)-[2-(cyclopropylamino)-1,2-dioxoethyl]pentyl]-3-[2(S)-[[[[1-[[(1,1-dimethylethyl)sulfonyl]methyl]cyclohexyl]amino]carbonyl]amino]-3,3-dimethyl-1-oxobutyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2(S)-carboxamide;(1R,2S,5S)-3-((S)-2-(3-(1-(tert-butylsulfonylmethyl)cyclohexyl)ureido)-3,3-dimethylbutanoyl)-N-((S)-1-(cyclopropylamino)-1,2-dioxoheptan-3-yl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;Narlaprevir (USAN/INN);
分子式：C36H61N5O7S
分子量：707.964
精确质量：707.429
Psa：186.21
Logp：6.4674
中文别名：
英文别名：narlaprevir;CS-0445;(1R,5S)-N-[1(S)-[2-(cyclopropylamino)-1,2-dioxoethyl]pentyl]-3-[2(S)-[[[[1-[[(1,1-dimethylethyl)sulfonyl]methyl]cyclohexyl]amino]carbonyl]amino]-3,3-dimethyl-1-oxobutyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2(S)-carboxamide;(1R,2S,5S)-3-((S)-2-(3-(1-(tert-butylsulfonylmethyl)cyclohexyl)ureido)-3,3-dimethylbutanoyl)-N-((S)-1-(cyclopropylamino)-1,2-dioxoheptan-3-yl)-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;Narlaprevir (USAN/INN);
分子式：C36H61N5O7S
分子量：707.964
精确质量：707.429
Psa：186.21
Logp：6.4674
编号系统
UNII：2857LA2O07
物化性质
密度：1.21
安全信息
生产方法及用途
合成路线
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参考文献
SCHERING CORPORATION; TRAVERSE, John; LEONG, William, W.; MILLER, Steven, P.; ALBANEZE-WALKER, Jennifer; HUNTER, Thomas, J.; WANG, Lijun; LIAO, Hongbiao; ARASAPPAN, Ashok; TRZASKA, Scott, T.; SMITH, Randi, M.; LEKHAL, Azzeddine; BOGEN, Stephane, L.; KONG, Jianshe; BENNETT, Frank; NJOROGE, F., George; POIRIER, Marc; KUO, Shen-Chun; CHEN, Yonggang; MATTHEWS, Kenneth S.; DEMONCHAUX, Patrice; FERREIRA, Amadeo Patent: WO2011/14494 A1, 2011 ; Location in patent: Page/Page column 46 ;
上游原料
下游产品
图谱
1H NMR : Predict
13C NMR : Predict
