6-allyl-7-chloro-3-(3 5-dimethylphenyl)-4-hydroxy-1H-quinolin-2-one | 199861-85-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 6-allyl-7-chloro-3-(3 5-dimethylphenyl)-4-hydroxy-1H-quinolin-2-one
• 英文别名: 6-allyl-7-chloro-3-(3,5-dimethylphenyl)-4-hydroxy-1H-quinolin-2-one；7-chloro-3-(3,5-dimethylphenyl)-4-hydroxy-6-prop-2-enyl-1H-quinolin-2-one
• CAS: 199861-85-3
• 化学式: C₂₀H₁₈ClNO₂
• 分子量: 339.821
• InChiKey: RNYHOENOMDWHCF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  24
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  49.3
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  6-allyl-7-chloro-3-(3 5-dimethylphenyl)-4-hydroxy-1H-quinolin-2-one 在 lead(IV) acetate 、 四氧化锇 、 N-甲基吲哚酮 、 三苯基膦 、 偶氮二甲酸二乙酯 作用下， 以 四氢呋喃 、 吡啶 、 甲醇 、 叔丁醇 为溶剂， 生成 2-{2-[6-carboxymethyl-7-chloro-3-(3,5-dimethylphenyl)-2-oxo-1,2-dihydroquinolin-4-yloxy]-ethyl}-piperidine-1-carboxylic acid tert-butyl ester
  参考文献：
  名称：

  Quinolones as gonadotropin releasing hormone (GnRH) antagonists: simultaneous optimization of the C(3)-aryl and C(6)-substituents

  摘要：

  A series of 3-arylquinolones was prepared and evaluated for their ability to act as gonadotropin releasing hormone (GnRH) antagonists. A variety of substitution patterns of the 3-aryl substituent are described. The 3,4,5-trimethylphenyl substituent (23h) was found to he optimal. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00318-8
• 作为产物：
  描述：

  3,5-dimethylphenylacetyl chloride 在 bis-triphenylphosphine-palladium(II) chloride 、 sodium hexamethyldisilazane 作用下， 以 四氢呋喃 、 1,2-二氯乙烷 、 N,N-二甲基甲酰胺 为溶剂， 生成 6-allyl-7-chloro-3-(3 5-dimethylphenyl)-4-hydroxy-1H-quinolin-2-one
  参考文献：
  名称：

  Quinolones as gonadotropin releasing hormone (GnRH) antagonists: simultaneous optimization of the C(3)-aryl and C(6)-substituents

  摘要：

  A series of 3-arylquinolones was prepared and evaluated for their ability to act as gonadotropin releasing hormone (GnRH) antagonists. A variety of substitution patterns of the 3-aryl substituent are described. The 3,4,5-trimethylphenyl substituent (23h) was found to he optimal. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00318-8

文献信息

• Antagonists of gonadotropin releasing hormone
  申请人：Merck & Co., Inc.

  公开号：US06150352A1

  公开（公告）日：2000-11-21

  There are disclosed compounds of formula (I) ##STR1## and pharmaceutically acceptable salts thereof which are useful as antagonists of GnRH and as such may be useful for the treatment of a variety of sex-hormone related conditions in both men and women.

  已披露了化合物的结构式（I）##STR1##及其药用盐，这些化合物可用作GnRH拮抗剂，因此可能有助于治疗男性和女性的各种性激素相关疾病。
• SUBSTITUTED THIAZOLO [3,2-ALPHA]AZEPINE DERIVATIVE
  申请人：Eisai Co., Ltd.

  公开号：EP0719779A1

  公开（公告）日：1996-07-03

  The present invention relates to a substituted thiazolo[3,2-a]azepine derivative having inhibitory activity against angiotensin I converting enzyme and neutral endpeptidase. The above substituted thiazolo[3,2-a]azepine derivative is represented by the following general formula (I):    (wherein R1 represents a hydrogen atom or a protecting group of a thiol group; R2 represents a hydrogen atom, a lower alkyl group, an aryl group which may have a substituent, a hetroaryl group which may have a substituent, a lower alkoxyl group or a lower alkylthio group; R3, R4 and R5 may be the same or different from one another and represent each a hydrogen atom, a lower alkyl group, a lower alkoxyl group, a lower alkylthio group or the like, with the proviso that the case wherein all of R3, R4 and R5 are hydrogen atoms are excepted;    R6 and R7 may be the same or different from each other and represent each a hydrogen atom or a lower alkyl group; R8 represents a hydrogen atom or a protecting group of a carboxyl group; and    m and m are each independently 0 or, 1 or 2).

  本发明涉及一种取代的噻唑并[3,2-a]氮杂卓衍生物，它对血管紧张素 I 转换酶和中性内肽酶具有抑制活性。 上述取代的噻唑并[3,2-a]氮杂卓衍生物由以下通式（I）表示： (其中 R1 代表氢原子或硫醇基的保护基团；R2 代表氢原子、低级烷基、可能具有取代基的芳基、可能具有取代基的己基芳基、低级烷氧基或低级烷硫基；R3、R4 和 R5 可以相同或不同，各自代表氢原子、低级烷基、低级烷氧基、低级烷硫基或类似基团，但 R3、R4 和 R5 全为氢原子的情况除外； R6 和 R7 可以相同或不同，各自代表氢原子或低级烷基；R8 代表氢原子或羧基的保护基；以及 m和m各自独立地为0或、1或2）。
• Novel processes for preparing intermediates of inhibitors of enkephalinase and angiotensin converting enzyme and intermediates thereof
  申请人：HOECHST MARION ROUSSEL, INC.

  公开号：EP0957109A2

  公开（公告）日：1999-11-17

  The present invention relates to novel processes for preparing intermediates of the formula I and to novel intermediates thereof which are useful in the preparation of inhibitors of enkephalinase and angiotensin converting enzyme.

  本发明涉及制备式 I 中间体的新型工艺，以及可用于制备脑啡肽酶和血管紧张素转换酶抑制剂的新型中间体。 及其新型中间体，这些中间体可用于制备脑啡肽酶和血管紧张素转换酶抑制剂。
• AMINOACETYLMERCAPTOACETYLAMIDE DERIVATIVES USEFUL AS INHIBITORS OF ENKEPHALINASE AND ACE
  申请人：MERRELL PHARMACEUTICALS INC.

  公开号：EP0625987B1

  公开（公告）日：1998-04-01
• ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE
  申请人：MERCK & CO., INC.

  公开号：EP0901471A1

  公开（公告）日：1999-03-17