CAS: 97229-11-3; 4-Chloro-2-(Methylsulfonyl)Pyrimidine

该化合物是一种七环有机化合物,其特点是以氯原子和甲基硫酰基组取代了一种环状,其分子分子式为C6H6ClN3O2S,表明碳,氢,氯,氮,氧和硫原子的存在.该化合物一般是一种固体,在极地有机溶剂中可溶解.它具有一些特性,如在标准条件下具有中度稳定性,但可能对坚固的碱基或酸敏感.甲基硫酰胺组的存在有助于其作为医药化学,特别是药品开发中的多功能建筑块的潜力.此外,氯原子可以影响化合物的再活性和生物活动,使其对各种化学合成和应用感兴趣.在处理和储存准则方面,应参考安全数据表,如任何化学物质一样.

英文名称4-Chloro-2-(Methylsulfonyl)Pyrimidine
中文名称4-氯-2-(甲基磺酰基)嘧啶
IUPAC名称4-Chloro-2-(methylsulfonyl)pyrimidine
其它别名2-甲磺基-4-氯嘧啶; Pyrimidine, 4-Chloro-2-(Methylsulfonyl)-
CAS编号97229-11-3
MFCD编号:MFCD09701372
EINECS号:156-030-0
分子式:C5H5ClN2O2S
分子量:192.62
产品CID: 2020514
产品分类有机原料→分子砌块→芳杂环类化合物→嘧啶类化合物

相似结构搜索
InChIKey: BWVZLXTZQHILRC-UHFFFAOYSA-N
InChI=1S/C5H5ClN2O2S/c1-11(9,10)5-7-3-2-4(6)8-5/h2-3H,1H3…
计算化学: 氢键受体数4.0氢键供体数0.0可旋转键数1.0

相似化合物

4489-34-3 1803805-58-4 325780-94-7

MSDS等安全信息

GHS符号GHS07
危险类别特定目标器官毒性 - 单次接触类别3
皮肤腐蚀/刺激类别2
严重眼刺激类别2A
警示词Warning
危险描述H335 |可能引起呼吸道刺激.
H315 |造成皮肤刺激.
H319 |造成严重眼刺激.
防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
危险品标志Xi
安全声明36/37
危险类别码20/21/22

欧盟法规

C&L通报

上下游产品

CAS号49844-90-8 4-氯-2-甲硫基嘧啶 | CAS号64741-01-1 m-chloro-peroxy... | CAS号5751-20-2 2-甲硫基-4-嘧啶酮 | CAS号3993-78-0 2-氨基-4-氯嘧啶 | CAS号56734-11-3 2-甲砜基-4-苯基嘧啶

合成工艺路线路线简述

合成目标产物 4-Chloro-2-(Methylsulfonyl)Pyrimidine 主要起始原料 2-Methylthio-4-Pyrimidinol
49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: Periodic Acid Solvents: Acetonitrile; 1 H,Rt1.2 Catalysts: Chromium Trioxide; 5 Min,Rt1.3 Solvents: Ethyl Acetate; 45 Min,0 °C; 1 H,0 °C1.4 Reagents: Sodium Sulfite Solvents: Water; 0 °C
标题:Chromium(Vi) Oxide Catalyzed Oxidation Of Sulfides To Sulfones With Periodic Acid
作者:Xu,Liang; Cheng,Jie; Trudell,Mark L.
参考文献:Journal Of Organic Chemistry 日期:2003 卷标:68(13) 页码:5388-5391]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: Hydrogen Peroxide Catalysts: Ammonium Molybdate ((Nh4)6Mo7O24) Solvents: Ethanol,Water; 0 °C; 0 °C -> Rt; Overnight,Rt
标题:Preparation Of Aminopyrimidine Compounds Useful For The Treatment Of Egfr Mutant Kinase Mediated Diseases
参考文献:China]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: M-Chloroperbenzoic Acid Solvents: Dichloromethane; 0 °C; 0 °C -> Rt; 2.5 H,Rt
标题:Preparation Of Indazole Compounds That Inhibit One Or More Receptor,Or Non-Receptor,Tyrosine Or Serine/threonine Kinase
参考文献:World Intellectual Property Organization]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: Hydrogen Peroxide Catalysts: Ammonium Molybdenum Oxide Solvents: Ethanol,Water; 2 H,Rt
标题:Improved Process For Preparing Lazertinib And Intermediates Thereof
参考文献:World Intellectual Property Organization]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: Potassium Peroxymonosulfate Sulfate (2Khso5.Khso4.K2So4) Solvents: Tetrahydrofuran,Water; 15 Min,0 °C; 0 °C -> Rt; 18 H,Rt
标题:Therapeutic Compounds And Methods Of Use Thereof
参考文献:United States]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: Potassium Peroxymonosulfate Sulfate (2Khso5.Khso4.K2So4) Solvents: Tetrahydrofuran,Water; 15 Min,0 °C; 0 °C -> Rt; 18 H,Rt
标题:Systematically Mitigating The P38α Activity Of Triazole-Based Bet Inhibitors
作者:Carlson,Angela S.; Cui,Huarui; Divakaran,Anand; Johnson,Jorden A.; Brunner,Ryan M.; Et Al
参考文献:Acs Medicinal Chemistry Letters 日期:2019 卷标:10(9) 页码:1296-1301]

= 97229-11-3 [标题:Reaction Conditions
标题:Preparation Heteroaryl Pyrimidinylamine Compounds And Compositions For Modulating Egfr Mutant Kinase Activities
参考文献:United States]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: Hydrogen Peroxide Catalysts: Ammonium Molybdate ((Nh4)6Mo7O24) Solvents: Ethanol,Water; 0 °C; 24 H,0 °C
标题:Synthesis Of Cytimidine Through A One-Pot Copper-Mediated Amidation Cascade
作者:Serrano,Catherine M.; Looper,Ryan E.
参考文献:Organic Letters 日期:2011 卷标:13(19) 页码:5000-5003]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: M-Chloroperbenzoic Acid Solvents: Dichloromethane; 2 H,Rt
标题:Preparation Of Variolin B Derivatives As Antitumor Agents
参考文献:World Intellectual Property Organization]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: Hydrogen Peroxide Catalysts: Ammonium Molybdate ((Nh4)6Mo7O24) Tetrahydrate Solvents: Ethanol; 10 °C; 12 H,37 °C1.2 Reagents: Sodium Sulfite Solvents: Water; 7 °C
标题:Sulfone Displacement Approach For Large-Scale Synthesis Of 4-Chloro-N-(1-Methyl-1H-Pyrazol-4-Yl)Pyrimidin-2-Amine
作者:Li,Chaomin; Haeffner,Fredrik; Wang,Shujun; Yuan,Cuicui; Shang,Deju; Et Al
参考文献:Organic Process Research & Development 日期:2022 卷标:26(1) 页码:137-143]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: Hydrogen Peroxide,Ammonium Molybdate ((Nh4)6Mo7O24) Tetrahydrate Solvents: Ethanol,Water; 0 °C; 0 °C -> Rt; Overnight,Rt
标题:Aminopyrimidine Compound Used For Inhibiting Activity Of Protein Kinase
参考文献:World Intellectual Property Organization]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: M-Chloroperbenzoic Acid Solvents: Dichloromethane; -5 °C; 30 Min,-5 °C; Overnight,-5 °C -> Rt
标题:Design,Synthesis,And Activity Of 2-Imidazol-1-Ylpyrimidine Derived Inducible Nitric Oxide Synthase Dimerization Inhibitors
作者:Davey,David D.; Adler,Marc; Arnaiz,Damian; Eagen,Keith; Erickson,Shawn; Et Al
参考文献:Journal Of Medicinal Chemistry 日期:2007 卷标:50(6) 页码:1146-1157]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: M-Chloroperbenzoic Acid Solvents: Dichloromethane; 0 °C; 2 H,Rt
标题:Heterocyclic Compounds For Targeted Degradation Of Ret And Their Preparation
参考文献:World Intellectual Property Organization]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: M-Chloroperbenzoic Acid Solvents: Dichloromethane; 30 Min,-5 °C; 15 H,Rt
标题:Novel In-Vivo Probe For Real Time Longitudinal Monitoring Of Inducible Nitric-Oxide Synthase In Living Cells And Animals
参考文献:World Intellectual Property Organization]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: M-Chloroperbenzoic Acid Solvents: Dichloromethane; Rt
标题:Preparation Of Substituted 4-(1-Pyrrolidinyl)Pyrimidine Compounds As Dimerization Inhibitors Of Neuronal Nitric Oxide Synthase
参考文献:World Intellectual Property Organization]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: Potassium Peroxymonosulfate Sulfate (2Khso5.Khso4.K2So4) Solvents: Methanol; Rt -> 0 °C; 2 H,0 °C1.2 Reagents: Sodium Bicarbonate Solvents: Water
标题:Preparation Of Fused Pyrazole Derivatives As P38 Map Kinase Inhibitors
参考文献:World Intellectual Property Organization]

49844-90-8 = 97229-11-3
反应条件:1.1 Reagents: M-Chloroperbenzoic Acid Solvents: Chloroform
标题:The Synthesis And Aminolysis Of Some 4-Chloro-2-(Substituted)Thiopyrimidines
作者:Hurst,Derek T.; Johnson,Matthew
参考文献:Heterocycles 日期:1985 卷标:23(3) 页码:611-16]

= 97229-11-3 [标题:Reaction Conditions
标题:Novel In-Vivo Probe For Real Time Longitudinal Monitoring Of Inducible Nitric-Oxide Synthase In Living Cells And Animals
参考文献:India]

= 97229-11-3 [标题:Reaction Conditions
标题:Preparation Of 2-[[(Phenoxy)Pyrimidinyloxy]Phenyl]-3-Methoxypropenoates As Agrochemical Fungicides
参考文献:European Patent Organization

2-甲硫基-4-氯嘧啶置于chromium(Vi) Oxide,高碘酸体系中,用乙酸乙酯,乙腈作为反应溶剂,化学反应 1.75H,以94%的收率获得产物4-氯-2-甲磺酰基嘧啶
参考文献:氧化铬(vi)用高碘酸催化将硫化物氧化为砜.
标题:氧化铬(vi)用高碘酸催化将硫化物氧化为砜.
摘要:描述了高效率和选择性氧化的高碘酸催化的cro(3)硫化物硫化为砜.在室温下,乙腈中含有2 Mol%cro(3)的各种富电子和电子不足的硫化物被氧化成砜,收率很高.具有其他易氧化官能团的硫化物在-35oc下用乙酸乙酯/乙腈中的10 Mol%cro(3)高产率选择性氧化为砜.
DOI:10.1021/jo030031N

海关参考信息

2930909099-其他有机硫化合物
2904990090-其他烃的磺化、硝化、亚硝化衍生物
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详情请参考：📖 海关编码查询和海关进出口税则

专利信息

专利号:US-6593347-B2
优先权日:1998-10-30
标题 :Nitrosated and nitrosylated nonsteroidal antiinflammatory compounds, compositions and methods of use
发明人：BANDARAGE UPUL K; DONG QING; FANG XINQIN; GARVEY DAVID S; MERCER GREGORY J; RICHARDSON STEWART K; SCHROEDER JOSEPH D; WANG TIANSHENG
权利人:NITROMED INC
摘要:The present invention describes novel nitrosated and/or nitrosylated nonsteroidal antiinflammatory compounds, and novel compositions comprising at least one nitrosated and/or nitrosylated nonsteroidal antiinflammatory compound, and, optionally, at least one compound that donates, transfers or releases nitric oxide, elevates endogenous levels of endothelium-derived relaxing factor, stimulates endogenous synthesis of nitric oxide or is a substrate for nitric oxide synthase. The present invention also provides methods for treating, preventing and/or reducing inflammation, pain, and fever; decreasing or reversing the gastrointestinal, renal and other toxicities resulting from the use of nonsteroidal antiinflammatory drugs; treating and/or preventing gastrointestinal disorders; treating inflammatory disease states and disorders; and treating and/or preventing ophthalmic diseases or disorders.

专利号:US-6936600-B2
优先权日:1999-04-01
标题:Sorbitol dehrydrogenase inhibitors
发明人：CHU-MOYER MARGARET Y; MYLARI BANAVARA L; ZEMBROWSKI WILLIAM J
权利人:PFIZER
摘要:This invention is directed to sorbitol dehydrogenase inhibitory compounds of the formula I, n n nwherein R 1 , R 2 and R 3 are as defined in the specification. This invention is also directed to pharmaceutical compositions containing those compounds and methods of treating or preventing diabetic complications, particularly diabetic neuropathy, diabetic nephropathy, diabetic microangiopathy, diabetic macroangiopathy and diabetic cardiomyopathy by administering such compounds to a mammal suffering from diabetes and therefore at risk for developing such complications. This invention is also directed to pharmaceutical compositions comprising a combination of a compound of formula I of this invention with an aldose reductase inhibitor and to methods of treating or preventing diabetic complications therewith. This invention is also directed to pharmaceutical compositions comprising a combination of a compound of formula I of this invention with an NHE-1 inhibitor and to methods of treating cardiomyopathy and other heart-related problems therewith. This invention is also directed to certain intermediates used in the synthesis of the compounds of formula I and to processes for preparing those intermediates.

专利号:US-9861636-B2
优先权日:2014-04-29
标题 :Polyfluorinated compounds acting as bruton tyrosine kinase inhibitors
发明人：HE WEI
权利人:HE WEI; ZHEJIANG DTRM BIOPHARMA CO LTD
摘要:Described herein is a novel series of multi-fluoro-substituted pyrazolopyrimidine compounds or salts thereof. These compounds are Bruton's tyrosine kinase (BTK) inhibitors. These compounds may possess better BTK inhibition selectivity and pharmacokinetic properties. Disclosed herein are the synthesis methods of these compounds. Disclosed herein are novel synthesis methods of the multi-fluoro-substituted benzophenone and substituted phenoxy benzene. Also disclosed are pharmaceutical compositions comprising the BTK inhibitors described herein. The present invention also relates to pharmaceutical formulations comprising the compounds described herein as active ingredients. The present invention also includes the therapeutic methods by administering the BTK inhibitors and their formulations to treat and inhibit autoimmune disease, hypersensitivity disease, inflammatory diseases and cancer.

专利号:RU-2019543-C1
优先权日:1989-02-10
标题 :Method of pyrimidine derivative synthesis

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参考文献:10.1055/s-0033-1338853
摘要:Moon Y, Baiazitov R, Du W, Lee C, Hwang S, Almstead N. Chemoselective Reactions of 4,6-Dichloro-2-(methylsulfonyl)pyrimidine and Related Electrophiles with Amines. Synthesis. 2013 Jun 11;45(13):1764–84. doi: 10.1055/s-0033-1338853.
参考文献:10.1055/s-0037-1609357
摘要:Manganese-Catalyzed Oxidative Kinetic Resolution of Heterocyclic Sulfoxides. Synfacts. 2018 Mar 15;14(04):0374. doi: 10.1055/s-0037-1609357.

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CAS: 97229-11-3; 4-Chloro-2-(Methylsulfonyl)Pyrimidine

相似化合物

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