3-(3-ethylphenyl)propan-1-ol | 1093172-84-9

• 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: 3-(3-ethylphenyl)propan-1-ol
• 英文别名: 3-(3-ethylphenyl)-1-propanol
• CAS: 1093172-84-9
• 化学式: C₁₁H₁₆O
• 分子量: 164.247
• InChiKey: FTYOXDLACAPIJL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  12
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  3-(3-ethylphenyl)propan-1-ol 在 N-溴代丁二酰亚胺(NBS) 、 三苯基膦 作用下， 以 二氯甲烷 为溶剂， 反应 6.0h， 生成 1-(3-bromopropyl)-3-ethylbenzene
  参考文献：
  名称：

  AMINE COMPOUND AND PHARMACEUTICAL USE THEREOF

  摘要：

  公开号：

  EP2168944B1
• 作为产物：
  描述：

  1-溴-3-乙基苯 在 bis-triphenylphosphine-palladium(II) chloride 、 copper(l) iodide 、 palladium 10% on activated carbon 、 氢气 、 三乙胺 作用下， 以 苯 为溶剂， 反应 48.0h， 生成 3-(3-ethylphenyl)propan-1-ol
  参考文献：
  名称：

  Role of the CAI-1 Fatty Acid Tail in the Vibrio cholerae Quorum Sensing Response

  摘要：

  Quorum sensing is a mechanism of chemical communication among bacteria that enables collective behaviors. In V. cholerae, the etiological agent of the disease cholera, quorum sensing controls group behaviors including virulence factor production and biofilm formation. The major V. cholerae quorum-sensing system consists of the extracellular signal molecule called CAI-1 and its cognate membrane bound receptor called CqsS. Here, the ligand binding activity of CqsS is probed with structural analogues of the natural signal. Enabled by our discovery of a structurally simplified analogue of CAI-1, we prepared and analyzed a focused library. The molecules were designed to probe the effects of conformational and structural changes along the length of the fatty acid tail of CAI-1. Our results, combined with pharmacophore modeling, suggest a molecular basis for signal molecule recognition and receptor fidelity with respect to the fatty acid tail portion of CAI-1. These efforts provide novel probes to enhance discovery of antivirulence agents for the treatment of V. cholerae.

  DOI：

  10.1021/jm300908t

文献信息

• Solid-Phase Supports and Uses Thereof
  申请人：Indiana University Research and Technology Corporation

  公开号：US20150240006A1

  公开（公告）日：2015-08-27

  The present disclosure relates to solid-phase azide supports, methods for making solid-state azide supports, and methods for capturing alkynes using the same. The present disclosure also relates to kits for solid-phase azide supports

  本公开涉及固相叠氮支持体，制备固态叠氮支持体的方法，以及利用它们捕获炔烃的方法。本公开还涉及固相叠氮支持体的试剂盒。
• Amine compound and pharmaceutical use thereof
  申请人：Mitsubishi Tanabe Pharma Corporation

  公开号：US08129361B2

  公开（公告）日：2012-03-06

  Provided is a novel amine compound represented by the following formula (I) having a superior peripheral blood lymphocyte decreasing action and superior in the immunosuppressive action, rejection suppressive action and the like, which shows decreased side effects of, for example, bradycardia and the like, or a pharmaceutically acceptable acid addition salt thereof, or a hydrate thereof, or a solvate thereof. wherein each symbol is as defined in the specification.

  提供的是一种新型胺类化合物，其化学式如下（I），具有卓越的外周血淋巴细胞降低作用和免疫抑制作用，抗排异作用等方面表现出降低副作用的优点，例如心动过缓等，或其药学上可接受的酸盐，或其水合物，或其溶剂化物。 其中，每个符号如规范中所定义。
• INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME
  申请人：OTSUKA PHARMACEUTICAL CO., LTD.

  公开号：EP0411150A1

  公开（公告）日：1991-02-06

  This invention relates to indole derivatives of general formula (1) and salts thereof, a method for preparing same, and applications thereof in the prevention and treatment of nephritis, wherein R represents hydrogen, cyano or one of various other substituents, 1 is an integer of 1 or 2, R' represents hydrogen, one of various substituents or a group of formula (2) (wherein A represents a single bond, -CH(OH)-, -CH=, -C(=0)- or alkyl, and R2, R3, R4, R5 and R6 each represents one of various substituents),and Z represents hydrogen or a group of formula (2) provided that R1 represents a group of formula (2) when Z represents hydrogen.

  本发明涉及通式(1)的吲哚衍生物及其盐、制备方法以及在预防和治疗肾炎中的应用，其中R代表氢、氰基或其它各种取代基之一，1为1或2的整数，R'代表氢、其中 A 代表单键、-CH(OH)-、-CH=、-C(=0)- 或烷基，R2、R3、R4、R5 和 R6 各代表各种取代基之一），Z 代表氢或式（2）基团，但当 Z 代表氢时，R1 代表式（2）基团。
• Pyrazine derivatives
  申请人：OTSUKA PHARMACEUTICAL CO., LTD.

  公开号：EP0511879B1

  公开（公告）日：1995-03-22
• US5238938A
  申请人：——

  公开号：US5238938A

  公开（公告）日：1993-08-24