4-[(4-Chloro-2-fluorophenyl)methylidene]piperidine-1-carboxylic acid

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: 4-[(4-Chloro-2-fluorophenyl)methylidene]piperidine-1-carboxylic acid
• 英文别名: 4-[(4-chloro-2-fluorophenyl)methylidene]piperidine-1-carboxylic acid
• 化学式: C₁₃H₁₃ClFNO₂
• 分子量: 269.7
• InChiKey: KEMQUKIEHYCHHN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  18
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  40.5
• 氢给体数：
  1
• 氢受体数：
  3

文献信息

• [EN] SULFONYL PIPERIDINE DERIVATIVES AND THEIR USE FOR TREATING PROKINETICIN MEDIATED DISEASES<br/>[FR] DÉRIVÉS DE SULFONYLPIPÉRIDINE ET LEUR UTILISATION POUR LE TRAITEMENT DE MALADIES MÉDIÉES PAR UNE PROKINÉTICINE
  申请人：TAKEDA PHARMACEUTICAL

  公开号：WO2013179024A1

  公开（公告）日：2013-12-05

  The present invention provides compounds of formula (I) and pharmaceutically acceptable salts thereof : (I) in which m, n, W, X, Y, Z, R1, R2, R3 and R4 are as defined in the specification, for use in the treatment or prevention of a diseases o conition mediated by a prokineticin, such as psychiatric and neurological conitions.

  本发明提供了以下式（I）的化合物及其药学上可接受的盐：（I）其中m、n、W、X、Y、Z、R1、R2、R3和R4如规范中定义，用于治疗或预防由前动力素介导的疾病或状况，如精神疾病和神经病状。
• [EN] MITOCHONDRIAL INHIBITORS FOR THE TREATMENT OF PROLIFERATION DISORDERS<br/>[FR] INHIBITEURS MITOCHONDRIALES POUR LE TRAITEMENT DE TROUBLES PROLIFÉRATIFS
  申请人：BASILEA PHARM INT AG

  公开号：WO2019115709A1

  公开（公告）日：2019-06-20

  The invention provides compounds of formula I or pharmaceutically acceptable salt thereof wherein Bl, B2, B3 and B4 represent independently C(R3); X represents -CH(R5)-, -C(R5)= or -(C=0)-, and wherein when X represents -CH(R5)- or -(C=0)- the dotted line represents a single bond, and when X represents -C(R5)= the dotted line represents a double bond; R1 represents independently at each occurrence methy, ethyl, methoxy or ethoxy; R2 represents halogen, cyano, hydroxyl, methyl, ethyl, methoxy, ethoxy, -N(R6a)(R6b) or -methylene- N(R6a)(R6b); R3 represents independently at each occurrence hydrogen, halogen, cyano or methyl; R4a represents methyl or ethyl; R4b represents halogen, Cl-C4alkyl, Cl-C4alkoxy or -0-Cl-C4alkylene-Cycle-Q; R5 represents hydrogen or methyl; R6a represents hydrogen or methyl; R6b represents hydrogen or methyl; Cycle-Q represents independently at each occurrence phenyl optionally substituted by 1 to 3 R7; R7 represents independently at each occurrence cyano, methyl, halomethyl, methoxy or halomethoxy; n is 1 or 2; and q is 0, 1 or 2; as well as methods of using the compounds to treat proliferation diseases, in particular cancer.

  该发明提供了公式I的化合物或其药用可接受的盐，其中Bl、B2、B3和B4分别独立地代表C（R3）；X代表-CH（R5）-、-C（R5）=或-(C=0)-，当X代表-CH（R5）-或-(C=0)-时，虚线代表单键，当X代表-C（R5）=时，虚线代表双键；R1在每次出现时独立地代表甲基、乙基、甲氧基或乙氧基；R2代表卤素、氰基、羟基、甲基、乙基、甲氧基、乙氧基、-N（R6a）（R6b）或-亚甲基-N（R6a）（R6b）；R3在每次出现时独立地代表氢、卤素、氰基或甲基；R4a代表甲基或乙基；R4b代表卤素、Cl-C4烷基、Cl-C4烷氧基或-0-Cl-C4烷基环-Q；R5代表氢或甲基；R6a代表氢或甲基；R6b代表氢或甲基；环-Q在每次出现时独立地代表苯环，可选择地被1至3个R7取代；R7在每次出现时独立地代表氰基、甲基、卤甲基、甲氧基或卤甲氧基；n为1或2；q为0、1或2；以及使用这些化合物治疗增殖性疾病，特别是癌症的方法。
• [EN] 1-SULFONYL PIPERIDINE DERIVATIVES AS MODULATORS OF PROKINETICIN RECEPTORS<br/>[FR] DÉRIVÉS DE 1-SULFONYL PIPÉRIDINE UTILISÉS EN TANT QUE MODULATEURS DES RÉCEPTEURS DE LA PROKINÉTICINE
  申请人：TAKEDA CAMBRIDGE LTD

  公开号：WO2014202999A1

  公开（公告）日：2014-12-24

  The present invention provides compounds of formula (I) and pharmaceutically acceptable salts thereof in which m, n, W, X, Y, Z, R1 , R2, R3, R4 and R5 are as defined in the specification, compositions containing them and their use in therapy.

  本发明提供了公式（I）中的化合物及其药用可接受的盐，其中m、n、W、X、Y、Z、R1、R2、R3、R4和R5如规范中定义，包含它们的组合物以及它们在治疗中的用途。
• [EN] SULFONYL PIPERIDINE DERIVATIVES AND THEIR USE FOR TREATING PROKINETICIN MEDIATED GASTROINTESTINAL DISORDERS<br/>[FR] DÉRIVÉS SULFONYL PIPÉRIDINE ET LEUR UTILISATION POUR LE TRAITEMENT DE TROUBLES GASTRO-INTESTINAUX MÉDIÉS PAR LA PROKINÉTICINE
  申请人：TAKEDA CAMBRIDGE LTD

  公开号：WO2016075457A1

  公开（公告）日：2016-05-19

  The present invention provides compounds of formula (I) and pharmaceutically acceptable salts thereof (Formula (I)) in which m, n, W, X, Y, Z, R1, R2, R3, R4 and R5 are as defined in the specification for use in treating irritable bowel syndrome or inflammatory bowel disease.

  本发明提供了式(I)的化合物及其药用盐（式(I)），其中m、n、W、X、Y、Z、R1、R2、R3、R4和R5如规范中所定义，用于治疗肠易激综合征或炎症性肠病。
• SULFONYL PIPERIDINE DERIVATIVES AND THEIR USE FOR TREATING PROKINETICIN MEDIATED DISEASES
  申请人：Takeda Pharmaceutical Company Limited

  公开号：EP2855449A1

  公开（公告）日：2015-04-08