2,4-二氯-5,6,7,8-四氢吡啶并[4,3-D]嘧啶盐酸盐 | 1208901-69-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶并嘧啶类
• 中文名称: 2,4-二氯-5,6,7,8-四氢吡啶并[4,3-D]嘧啶盐酸盐
• 中文别名: 2,4-二氯-5,6,7,8-四氢
• 英文名称: 2,4-dichloro-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine hydrochloride
• 英文别名: 2,4-dichloro-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine;hydrochloride
• CAS: 1208901-69-2
• 化学式: C₇H₇Cl₂N₃*ClH
• 分子量: 240.52
• InChiKey: MDEUNLWIRLXZJC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.85
• 重原子数：
  13
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  37.8
• 氢给体数：
  2
• 氢受体数：
  3

安全信息

• 海关编码：
  2933990090
• 危险性防范说明：
  P261,P305+P351+P338
• 危险性描述：
  H302,H315,H319
• 储存条件：
  存储条件：2-8℃，请避免光照并保持干燥密封。

反应信息

• 作为反应物：
  描述：

  2,4-二氯-5,6,7,8-四氢吡啶并[4,3-D]嘧啶盐酸盐 在 N,N-二异丙基乙胺 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 1.0h， 生成 (S)-tert-butyl 2-chloro-4-(3-methylmorpholino)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate
  参考文献：
  名称：

  Potent, Selective, and Orally Bioavailable Inhibitors of the Mammalian Target of Rapamycin Kinase Domain Exhibiting Single Agent Antiproliferative Activity

  摘要：

  Selective inhibitors of mammalian target of rapamycin (mTOR) kinase based upon saturated heterocycles fused to a pyrimidine core were designed and synthesized. Each series produced compounds with K-i < 10 nM for the mTOR kinase and >500-fold selectivity over closely related PI3 kinases. This potency translated into strong pathway inhibition, as measured by phosphorylation of mTOR substrate proteins and antiproliferative activity in cell lines with a constitutively active PI3K pathway. Two compounds exhibiting suitable mouse PK were profiled in in vivo tumor models and were shown to suppress mTORC1 and mTORC2 signaling for over 12 h when dosed orally. Both compounds were additionally shown to suppress tumor growth in vivo in a PC3 prostate cancer model over a 14 day study.

  DOI：

  10.1021/jm301389h
• 作为产物：
  描述：

  6-苯甲基-5,6,7,8-四氢-1H-哌啶并[4,3-D]2,4-二嘧啶酮 在 氯甲酸氯甲酯 、 三乙胺 、 三氯氧磷 作用下， 以 1,2-二氯乙烷 为溶剂， 反应 10.0h， 生成 2,4-二氯-5,6,7,8-四氢吡啶并[4,3-D]嘧啶盐酸盐
  参考文献：
  名称：

  PREVENTIVE AND/OR THERAPEUTIC DRUGS FOR ITCH

  摘要：

  本发明提供了一种用于预防和/或治疗瘙痒的药剂，包括一种能够抑制参与GPR4信号转导功能的物质作为活性成分。它还提供了一种由式（I）表示的含氮三环化合物或其季铵盐，或其药用可接受盐；[其中R1代表取代或未取代的较低烷基等；R2代表氢、取代或未取代的较低烷基等；R3和R4相同或不同，各自代表氢、较低烷基等；n代表0或1；X代表-(CH2)2-等；Y代表式（II）；（其中W代表CH或氮原子；Z1和Z2相同或不同，各自代表氢、取代或未取代的较低烷基等；Z3代表氢、取代或未取代的较低烷基等）]

  公开号：

  EP1547616A1

文献信息

• [EN] SUBSTITUTED 1,1'-BIPHENYL COMPOUNDS AND METHODS USING SAME<br/>[FR] COMPOSÉS 1,1'-BIPHÉNYLE SUBSTITUÉS ET LEURS PROCÉDÉS D'UTILISATION
  申请人：ARBUTUS BIOPHARMA INC

  公开号：WO2021158481A1

  公开（公告）日：2021-08-12

  The present invention includes substituted 1,1'-biphenyl compounds, analogues thereof, and compositions comprising the same. In one aspect, the compounds contemplated in the invention can be used to treat, ameliorate, or prevent hepatitis B virus (HBV) and/or hepatitis D virus (HDV) infections in a patient. In another aspect, the compounds contemplated in the invention can be used to treat, ameliorate, and/or prevent cancer in a patient.

  本发明包括取代的1,1'-联苯化合物，其类似物，以及包含它们的组合物。在一个方面，本发明中考虑的化合物可用于治疗、改善或预防患者体内的乙型肝炎病毒（HBV）和/或丙型肝炎病毒（HDV）感染。在另一个方面，本发明中考虑的化合物可用于治疗、改善和/或预防患者体内的癌症。
• [EN] GLUCOSE UPTAKE INHIBITORS<br/>[FR] INHIBITEURS D'ABSORPTION DU GLUCOSE
  申请人：KADMON CORP LLC

  公开号：WO2016210330A1

  公开（公告）日：2016-12-29

  Provided hererin are compounds that modulate glucose uptake activityand are useful for treating cancer, autoimmune diseases, inflammation, infectious diseases, and metabolic diseases. In certain embodiments, the compounds modulate glucose uptake activity by modulating cellular components, including, but not limited to those related to glycolysis and known transporters/co-transporters of glucose such as GLUT1 and other GLUT family members/alternative hexose transporters. In certain embodiments, the compounds have the structure of formula I: Formula (I) wherein the variables have the values disclosed herein.

  本文提供了调节葡萄糖摄取活性的化合物，可用于治疗癌症、自身免疫疾病、炎症、传染病和代谢性疾病。在某些实施例中，这些化合物通过调节细胞组分来调节葡萄糖摄取活性，包括但不限于与糖酵解和已知的葡萄糖转运蛋白/共转运蛋白（如GLUT1和其他GLUT家族成员/替代己糖转运蛋白）有关的组分。在某些实施例中，这些化合物具有以下结构的结构：公式（I）其中变量具有此处披露的值。
• BICYCLIC PYRIMIDINE DERIVATIVES
  申请人：KYOWA HAKKO KOGYO CO., LTD.

  公开号：EP1552842A1

  公开（公告）日：2005-07-13

  [wherein m and n may be the same or different and each represents an integer of 1 to 3 wherein m + n is 4 or less; R1 represents NR4R5 (wherein R4 and R5 may be the same or different and each represents a hydrogen atom, substituted or unsubstituted lower alkyl, substituted or unsubstituted aralkyl or the like); R2 represents the above Formula (II), Formula (IV) or the like; A represents a single bond, -C(=O)-, -SO2-, -OC(=O)- or the like; and R3 represents substituted or unsubstituted lower alkyl, substituted or unsubstituted cycloalkyl, substituted or unsubstituted aralkyl or the like] Bicyclic pyrimidine derivatives represented by the above Formula (I), or quaternary ammonium salts thereof, or pharmaceutically acceptable salts thereof, or the like, are provided. These have anti-inflammatory activities or modulation activities on the functions of TARC and/or MDC and are useful for treating and/or preventing a disease which is related to T cells, such as an allergic disease, an autoimmune disease or transplant rejection.

  提供上述公式（I）所代表的双环嘧啶衍生物，或其季铵盐，或其药用盐等。这些化合物具有抗炎活性或对TARC和/或MDC功能的调节活性，并且可用于治疗和/或预防与T细胞相关的疾病，如过敏性疾病、自身免疫疾病或移植排斥等。
• [EN] TREATMENT OF INFECTIOUS DISEASES WITH GLUCOSE UPTAKE INHIBITORS<br/>[FR] TRAITEMENT DE MALADIES INFECTIEUSES À L'AIDE D'INHIBITEURS D'ABSORPTION DU GLUCOSE
  申请人：KADMON CORP LLC

  公开号：WO2016210331A1

  公开（公告）日：2016-12-29

  Provided are methods of treating infectious diseases in mammals comprising administering a compound that inhibits glucose uptake. Particular infectious diseases that may be treated include malaria, leishmaniasis, African trypanosomiasis, tuberculosis, HIV, HCMV or herpes virus. In a first aspect, the invention features a method of treating infectious diseases in a mammal, comprising administering to a mammalian subject in need thereof a therapeutically effective amount of a compound or prodrug thereof, or pharmaceutically acceptable salt or ester of said compound or prodrug, wherein the compound is an inhibitor of glucose uptake.

  提供了一种治疗哺乳动物传染病的方法，包括给予抑制葡萄糖摄入的化合物。可能被治疗的特定传染病包括疟疾、利什曼病、非洲锥虫病、结核病、HIV、HCMV或疱疹病毒。在第一个方面，本发明涉及一种治疗哺乳动物传染病的方法，包括向需要的哺乳动物主体给予治疗有效量的化合物或其前药，或该化合物或前药的药学上可接受的盐或酯，其中该化合物是葡萄糖摄入抑制剂。
• TOLL LIKE RECEPTOR MODULATOR COMPOUNDS
  申请人：Gilead Sciences, Inc.

  公开号：US20180065938A1

  公开（公告）日：2018-03-08

  This application relates generally to toll like receptor modulator compounds and pharmaceutical compositions which, among other things, modulate toll-like receptors (e.g. TLR8), and methods of making and using them.

  该应用程序通常涉及调节Toll样受体调节剂化合物和药物组合物，这些化合物在其他方面调节Toll样受体（例如TLR8），以及制备和使用它们的方法。