α-Guajacyl-propanol | 3147-29-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: α-Guajacyl-propanol
• 英文别名: 2-(2-Methoxy-phenoxy)-propanol；2-(2-Methoxyphenoxy)propan-1-ol
• CAS: 3147-29-3
• 化学式: C₁₀H₁₄O₃
• 分子量: 182.219
• InChiKey: WRHUYIWXWQPJPA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  13
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  38.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  α-Guajacyl-propanol 在 吡啶 、 氯化亚砜 作用下， 生成 2-(2-Methoxy-phenoxy)-propylchlorid
  参考文献：
  名称：

  一系列芳基烷基酰胺的一些心血管作用。一世。

  摘要：

  DOI：

  10.1021/jm00327a017
• 作为产物：
  描述：

  2-(2-甲氧基苯氧基)丙酸乙酯 在 二异丁基氢化铝 作用下， 以 二氯甲烷 、 甲苯 为溶剂， 生成 α-Guajacyl-propanol
  参考文献：
  名称：

  Lead-Discovery of bis-Aromatic Alkynes: A Novel Class of Herbicides

  摘要：

  寻找具有新颖作用方式和理想物理特性的新活性分子是一项持续进行的努力。本出版物描述了在先正达作物保护的筛选系统中发现的生物活性物质的后续化学研究，该系统是辛吉塔作物保护的传统农药母公司。通过经典合成方法和自动并行合成对这种化学物质进行了优化，涵盖了重要的物理特性，如亲脂性或Clog P和溶解度。介绍了来自温室和田间数据的初步生物活性和症状学。

  DOI：

  10.2533/chimia.2008.23

文献信息

• Johansson,B.; Miksche,G.E., Acta Chemica Scandinavica (1947), 1972, vol. 26, p. 289 - 308
  作者：Johansson,B.、Miksche,G.E.

  DOI：——

  日期：——
• NOVEL COMPOUNDS, THEIR USE AND PREPARATION
  申请人：Pharmacia AB

  公开号：EP1178973A2

  公开（公告）日：2002-02-13
• [EN] NOVEL COMPOUNDS, THEIR USE AND PREPARATION<br/>[FR] NOUVEAUX COMPOSES, ET UTILISATION ET PREPARATION DE CES DERNIERS
  申请人：PHARMACIA & UPJOHN AB

  公开号：WO2000076984A2

  公开（公告）日：2000-12-21

  The invention relates to compounds of general formula (I) wherein Ar is optionally substituted aryl or heteroaryl; A is (i) -O-, -S-, -SO2-, -NH-, (ii) a C1-4-alkyl- or C1-6-acyl-substituted nitrogen atom or (iii) a C1-8-alkylene chain or a heteroalkylene chain having 2 to 8 chain atoms, which optionally contains at least one unsaturation, and which may be substituted and/or contain a bridge to form a saturated or partially or fully unsaturated ring having 3-8 ring members; B is -C(R4)(R5)-, -OC(R4)(R5)-, -N(R6)C(R4)(R5)-, -N(R6)-O-, -S- or -SO2-; R is optionally substituted C3-8-cycloalkyl, aryl or heteroaryl; R1 is (i) a saturated or unsaturated azacyclic or aminoazacyclic ring, or a saturated diazacyclic or aminodiazacyclic ring, which has 4 to 7 ring members, or a saturated aminoazabicyclic, azabicyclic or diazabicyclic ring which has 7 to 10 ring members, which rings optionally are substituted in one or more positions, or a group -[C(R4)(R5)]xN(R2a)(R3a)]; R2a, R3a, R4, R5, R6 and x are as defined in the claims, and n is 0 or 1; and pharmaceutically acceptable salts, hydrates and prodrug forms thereof. The compounds may be prepared by per se conventional methods and can be used for treating a human or animal subject suffering from a serotonin-related disorder, such as eating disorders, especially obesity, memory disorders, schizophrenia, mood disorders, anxiety disorders, pain, sexual dysfunctions, and urinary disorders. The invention also relates to such use as well as to pharmaceutical compositions comprising a compound of formula (I).
• Some Cardiovascular Effects of a Series of Aryloxyalkylamines. I
  作者：J. Augstein、W. C. Austin、R. J. Boscott、S. M. Green、C. R. Worthing

  DOI：10.1021/jm00327a017

  日期：1965.5
• Lead-Discovery of bis-Aromatic Alkynes: A Novel Class of Herbicides
  作者：Jutta Glock、Peter D. J. Grootenhuis、Steven Bondy、Daniel D. Comer、Soan Cheng、Arthur Steiger、Martin Zeller、Grit Laue、Adrian Friedmann、Olivier Jacob、Mafalda Nina、Hans-Jürg Widmer、Klaus Kreuz、Julie E. Penzotti、Hans Brunner、James Allen、Thierry Niderman、Hans Ulrich Haas、Renold Chollet、Martin Eberle、Peter Renold、William Lutz、Jürg Ehrler、Marian Valentini、Markus Walti、Evelyne Sieger、Thomas Vettiger、G. Wayne Craig

  DOI：10.2533/chimia.2008.23

  日期：——

  The search for new active molecules with novel modes of action and desirable physical properties is an ongoing endeavour. This publication describes the follow-up chemistry of a biological hit discovered in the screening system of Novartis Crop Protection, the legacy agrochemical parent of Syngenta Crop Protection. This chemistry was optimized through classical synthetic methods and automated parallel synthesis with coverage of important physical properties such as lipophilicity or Clog P and solubility. Preliminary biological activity from the greenhouse and field data with symptomology is presented.

  寻找具有新颖作用方式和理想物理特性的新活性分子是一项持续进行的努力。本出版物描述了在先正达作物保护的筛选系统中发现的生物活性物质的后续化学研究，该系统是辛吉塔作物保护的传统农药母公司。通过经典合成方法和自动并行合成对这种化学物质进行了优化，涵盖了重要的物理特性，如亲脂性或Clog P和溶解度。介绍了来自温室和田间数据的初步生物活性和症状学。