CAS: 1187594-13-3; 2-(1-(Ethylsulfonyl)-3-(4-(7-((2-(Trimethylsilyl)Ethoxy)Methyl)-7H-Pyrrolo[2,3-D]Pyrimidin-4-yl)-1H-Pyrazol-1-yl)Azetidin-3-yl)Acetonitrile

该化合物是一个复杂的有机化合物,其特点是其复杂的分子结构.该化学品具有多种功能组,包括乙硫酰和硝酸盐组,有助于其化学反应和潜在的生物活动.一个火药杆菌和火花环系统的存在表明,它可能具有有趣的药用药化学生物活性剂.此外,三甲基硅组表示在有机合成或化学反应中作为保护性组的潜在应用.该化合物的溶解性,稳定性和再活性将取决于其具体的分子相互作用和潜在生物反应环境,这取决于其化学反应的特性和潜在化合物的结构.这一混合物的特性及其结构的形成可能具有某种潜在性.

英文名称2-(1-(Ethylsulfonyl)-3-(4-(7-((2-(Trimethylsilyl)Ethoxy)Methyl)-7H-Pyrrolo[2,3-D]Pyrimidin-4-yl)-1H-Pyrazol-1-yl)Azetidin-3-yl)Acetonitrile
中文名称BARICITINIB中间体
IUPAC名称2-(1-(ethylsulfonyl)-3-(4-(7-((2-(trimethylsilyl)ethoxy)methyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)azetidin-3-yl)acetonitrile
其它别名2-(1-(Ethylsulfonyl)-3-(4-(7-((2-(Trimethylsilyl)Ethoxy)Methyl)-7H-Pyrrolo[2,3-D]Pyrimidin-4-yl)-1H-Pyrazol-1-yl)Azetidin-3-yl)Acetonitrile; 2-[1-Ethanesulfonyl-3-[4-(7-[(2-(Trimethylsilyl)Ethoxy)Methyl]-7H-Pyrrolo[2,3-D]Pyrimidine-4-yl)-1H-Pyrazol-1-Yl]Azetidin-3-Yl]Acetonitrile; 2-[1-Ethylsulfonyl-3-[4-(7H-Pyrrolo[2,3-D]Pyrimidin-4-yl)Pyrazol-1-Yl]Azetidin-3-Yl]Acetonitrile; Barretinib Intermediate 2; 3-Azetidineacetonitrile, 1-(Ethylsulfonyl)-3-[4-[7-[[2-(Trimethylsilyl)Ethoxy]Methyl]-7H-Pyrrolo[2,3-D]Pyrimidin-4-Yl]-1H-Pyrazol-1-Yl]-; 2-[1-Ethanesulfonyl-3-[4-(7-[(2-(Trimethylsilyl)Ethoxy)Methyl]-7H-Pyrrolo[2,3-D]Pyrimidine-4-yl)-1H-Yl]Azetidin-3-Yl]Acetonitrile; (Trimethylsilyl)Ethoxy)Methyl)-7H-Pyrrolo[2,3-D]Pyrimidin-4-yl)-1H-Pyrazol-1-yl)Azetidin-3-yl)Acetonitrile; 1-(Ethylsulfonyl)-3-[4-[7-[[2-(Trimethylsilyl)Ethoxy]Methyl]-7H-Pyrrolo[2,3-D]Pyrimidine
CAS编号1187594-13-3
MFCD编号:MFCD33551930
FDA UNII编号:Q32W8S3LS7
分子式:C22H31N7O3SSi
分子量:501.69
产品CID: 245318
产品分类医药中间体 → 原料药中间体

相似结构搜索
InChIKey: WUWJJJDMZWZKQS-UHFFFAOYSA-N
InChI=1S/C22H31N7O3SSi/c1-5-33(30,31)28-14-22(15-28,7-8-23)29-13-18(12-26-29)20-19-6-9-27(21(19)25-16-24-20)17-32-10-11-34(2,3)4/h6,9,12-13,…
计算化学: 氢键受体数8.0氢键供体数0.0可旋转键数10.0

MSDS等安全信息

警示词Warning
危险描述H302-H315-H319-
防范说明P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P501-

上下游产品

2-(3-(4-(7-((2-(Trimethylsilyl)Ethoxy)Methyl)-7H-Pyrrolo[2,3-D]Pyrimidin-4-yl)-1H-Pyrazol-1-yl)Azetidin-3-yl)Acetonitrile 1187594-12-2
4-(1H-吡唑-4-基)-7-((2-(三甲基甲硅烷基)乙氧基)-甲基)-7H-吡咯并[2,3-D]嘧啶 4-(1H-Pyrazol-4-yl)-7-((2-(Trimethylsilyl)Ethoxy)Methyl)-7H-Pyrrolo[2,3-D]Pyrimidine 941685-27-4

合成工艺路线路线简述

合成目标产物 2-(1-(Ethylsulfonyl)-3-(4-(7-((2-(Trimethylsilyl)Ethoxy)Methyl)-7H-Pyrrolo[2,3-D]Pyrimidin-4-yl)-1H-Pyrazol-1-yl)Azetidin-3-yl)Acetonitrile 主要起始原料 3-Azetidineacetonitrile, 3-[4-[7-[[2-(Trimethylsilyl)Ethoxy]Methyl]-7H-Pyrrolo[2,3-D]Pyrimidin-4-Yl]-1H-Pyrazol-1-Yl]- And Ethanesulfonyl Chloride
(文献来源)合成步骤主要原料 3-Azetidineacetonitrile, 3-[4-[7-[[2-(Trimethylsilyl)Ethoxy]Methyl]-7H-Pyrrolo[2,3-D]Pyrimidin-4-Yl]-1H-Pyrazol-1-Yl]- 和 Ethanesulfonyl Chloride

4-氯吡咯并嘧啶置于sodium Hydride,Potassium Carbonate,1,8-二氮杂双环[5.4.0]十一碳-7-烯体系中,用 1,4-二氧六环,水,N,N-二甲基甲酰胺,乙腈,Mineral Oil 用作溶剂,化学反应 1.17H,反应生成2-(1-(乙基磺酰基)-3-(4-(7-((2-(三甲基甲硅烷基)乙氧基)甲基)-7H-吡咯并[2,3-D]嘧啶-4-基)-1H-吡唑-1-基)氮杂环丁烷-3-基)乙腈
参考文献:Azetidine Derivative,Preparation Method Therefor,And Use Thereof
标题:Azetidine Derivative,Preparation Method Therefor,And Use Thereof