(4-β-hydroxyethoxy) phenyl propane | 74220-60-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (4-β-hydroxyethoxy) phenyl propane
• 英文别名: 1-[4-(2-hydroxyethoxy)-phenyl]propane；2-(4-Propylphenoxy)ethanol
• CAS: 74220-60-3
• 化学式: C₁₁H₁₆O₂
• 分子量: 180.247
• InChiKey: YIFFAEJYCUTZAO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  13
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (4-β-hydroxyethoxy) phenyl propane 在 乙醇 、 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 反应 19.0h， 生成 1-(4-(2-(tert-butyl)phenyl)piperazin-1-yl)-3-(2-(4-propylphenoxy)ethoxy)propan-2-ol
  参考文献：
  名称：

  Synthesis and evaluation of a novel class Hsp90 inhibitors containing 1-phenylpiperazine scaffold

  摘要：

  Previously, we identified 1-(2-(4-bromophenoxy) ethoxy)-3-(4-(2-methoxyphenyl) piperazin-1-yl) propan- 2-ol (1) as a novel Hsp90 inhibitor with moderate activity through virtual screening. In this study, we report the optimization process of 1. A series of analogues containing the 1-phenylpiperazine core scaffold were synthesized and evaluated. The structure-activity relationships (SAR) for these compounds was also discussed for further molecular design. This effort afforded the most active inhibitor 13f with improved activity in not only target-based level, but also cell-based level compared with the original hit 1. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2014.01.070
• 作为产物：
  描述：

  4-丙基苯酚 、 2-氯乙醇 在 sodium hydroxide 作用下， 以 水 为溶剂， 反应 24.0h， 生成 (4-β-hydroxyethoxy) phenyl propane
  参考文献：
  名称：

  Synthesis and evaluation of a novel class Hsp90 inhibitors containing 1-phenylpiperazine scaffold

  摘要：

  Previously, we identified 1-(2-(4-bromophenoxy) ethoxy)-3-(4-(2-methoxyphenyl) piperazin-1-yl) propan- 2-ol (1) as a novel Hsp90 inhibitor with moderate activity through virtual screening. In this study, we report the optimization process of 1. A series of analogues containing the 1-phenylpiperazine core scaffold were synthesized and evaluated. The structure-activity relationships (SAR) for these compounds was also discussed for further molecular design. This effort afforded the most active inhibitor 13f with improved activity in not only target-based level, but also cell-based level compared with the original hit 1. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2014.01.070

文献信息

• [EN] RADIOLABELED AMINO ACIDS FOR DIAGNOSTIC IMAGING<br/>[FR] ACIDES AMINÉS RADIO-MARQUÉS POUR IMAGERIE DE DIAGNOSTIC
  申请人：BAYER PHARMA AG

  公开号：WO2012150220A1

  公开（公告）日：2012-11-08

  This invention relates to novel compounds suitable for labeling by 18F and to the corresponding 18F labeled compounds themselves, 19F-fluorinated analogues thereof and their use as reference standards, methods of preparing such compounds, compositions comprising such compounds, kits comprising such compounds or compositions and uses of such compounds, compositions or kits for diagnostic imaging by Positron Emission Tomography (PET).

  这项发明涉及适合用18F标记的新化合物，以及相应的18F标记化合物本身，其19F-氟化类似物及其作为参考标准的用途，制备这种化合物的方法，包含这种化合物的组合物，包含这种化合物或组合物的试剂盒以及用于正电子发射断层扫描（PET）的这种化合物、组合物或试剂盒的用途。
• Polyester Compositions Containing Metathesis Polymers with Reduced Recycle Color
  申请人：Pawlow James

  公开号：US20090306268A1

  公开（公告）日：2009-12-10

  The present disclosure relates to aromatic polyester compositions, such as PET, comprising an unsaturated polymer prepared by metathesis polymerization having at least one or more specified terminal functional groups.

  本公开涉及芳香族聚酯组合物，例如PET，其中包括通过交换聚合制备的具有至少一个或多个指定末端功能基团的不饱和聚合物。
• HETERO RING DERIVATIVE
  申请人：Takahashi Fumie

  公开号：US20120165309A1

  公开（公告）日：2012-06-28

  [Object] A novel and excellent method for preventing or treating rejection in the transplantation of various organs, allergy diseases, autoimmune diseases, hematologic tumor, or the like, based on a PI3Kδ-selective inhibitory action and/or an IL-2 production inhibitory action, and/or a B cell proliferation inhibitory action (including an activation inhibitory action), is provided [Means for Solution] It was found that a 3-substituted triazine or 3-substituted pyrimidine derivative exhibits a PI3Kδ-selective inhibitory action, and/or an IL-2 production inhibitory action, and/or a B cell proliferation inhibitory action (including an activation inhibitory action), and can be an agent for preventing or treating rejection in the transplantation of various organs, allergy diseases (asthma, atopic dermatitis, etc.), autoimmune diseases (rheumatoid arthritis, psoriasis, ulcerative colitis, Crohn's disease, systemic lupus erythematosus, etc.), hematologic tumor (leukemia etc.), or the like, thereby completing the present invention.

  [目标]提供一种基于PI3Kδ选择性抑制作用和/或IL-2产生抑制作用和/或B细胞增殖抑制作用（包括激活抑制作用）的新颖优良方法，用于预防或治疗各种器官移植、过敏性疾病、自身免疫性疾病、血液肿瘤等的排斥反应。 [解决方案]发现3-取代-1,3,5-三嗪或3-取代嘧啶衍生物表现出PI3Kδ选择性抑制作用和/或IL-2产生抑制作用和/或B细胞增殖抑制作用（包括激活抑制作用），可以作为预防或治疗各种器官移植、过敏性疾病（哮喘、特应性皮炎等）、自身免疫性疾病（类风湿性关节炎、银屑病、溃疡性结肠炎、克罗恩病、系统性红斑狼疮等）、血液肿瘤（白血病等）等排斥反应的药物，从而完成了本发明。
• Low-shrinking unsaturated polyester composition
  申请人：NIPPON OIL AND FATS COMPANY, LIMITED

  公开号：EP0231881A1

  公开（公告）日：1987-08-12

  By subjecting polymer having high compatibility to an unsaturated polyester resin to an elastomer, it is possible to suppress separation of the elastomer from the unsaturated polyester resin, and to provide dispersion stability, thereby imparting the molding with low-shrinking property and excellent surface smoothness and toughness.

  通过将与不饱和聚酯树脂具有高兼容性的聚合物与弹性体混合，可以抑制弹性体与不饱和聚酯树脂的分离，并提供分散稳定性，从而使成型品具有低收缩性和出色的表面平滑性及韧性。
• Modifizierte Polyesterharze, ein Verfahren zu deren Herstellung und Toner, die solche Polyesterharze enthalten
  申请人：BAYER AG

  公开号：EP0492237A1

  公开（公告）日：1992-07-01

  Modifizierte Polyesterharze enthalten Polyesterblöcke, die aus Dicarbonsäuren und Dialkoholen erhalten wurden, Gruppierungen der Formeln mit X = Z = einem Kohlenwasserstoffrest mit 1 bis 20 C-Atomen und Y = einem Kohlenwasserstoffrest mit 2 bis 25 C-Atomen, sowie gegebenenfalls Gruppierungen stammend aus Vernetzern. Sie können als Basispolymere für Toner verwendet werden.

  改性聚酯树脂含有从二羧酸和二元醇中获得的聚酯块，其组式为 其中 X = Z = 具有 1 至 20 个碳原子的烃残基，Y = 具有 2 至 25 个碳原子的烃残基，以及由交联剂衍生的基团。它们可用作调色剂的基础聚合物。