黑染料 | 168194-08-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 黑染料
• 英文名称: 4-methallyl-benzoic acid
• 英文别名: 4-Methallyl-benzoesaeure；4-(2-Methyl-2-propenyl)benzoic acid；4-(2-methylprop-2-enyl)benzoic acid
• CAS: 168194-08-9
• 化学式: C₁₁H₁₂O₂
• mdl: MFCD02259931
• 分子量: 176.215
• InChiKey: SAMZPPSIMZAULA-UHFFFAOYSA-N

物化性质

• 熔点：
  161.5-163.5 °C(Solv: ethanol (64-17-5))
• 沸点：
  301.0±21.0 °C(Predicted)
• 密度：
  1.083±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  13
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.181
• 拓扑面积：
  37.3
• 氢给体数：
  1
• 氢受体数：
  2

安全信息

• 海关编码：
  2916399090

反应信息

• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 在 水 作用下， 生成 黑染料
  参考文献：
  名称：

  US2677678

  摘要：

  公开号：

文献信息

• [EN] 1- (2H-PYRAZOL -3-YL) -3YL) {4-`1- (BENZOYL) -PIPERIDIN-4-YLMETHYL!-PHENYL}-UREA DERIVATIVES AND RELATED COMPOUNDS AS INHBITORS OF P38 KINASE AND/OR TNF INHIBITORS FOR THE TREATMENT OF IMFLAMMATIONS<br/>[FR] DERIVES DE 1-(2H-PYRAZOL-3-YL)-3-{4-`1-(BENZOYL)-PIPERIDIN-4-YLMETHYL!-PHENYL}-UREE ET COMPOSES ASSOCIES UTILISES COMME INHIBITEURS DE LA KINASE P38 ET/OU COMME INHIBITEURS DU FACTEUR DE NECROSE TUMORALE (TNF) DANS LE TRAITEMENT DES INFLAMMATIONS
  申请人：AVENTIS PHARMA INC

  公开号：WO2004100946A1

  公开（公告）日：2004-11-25

  The present invention provides compounds of Formula (I) Wherein ( ) is an optional ethylene bridge; R1 is alkyl, cycloalkyl, aryl or aryl substituted with one or more substituents selected from alkyl, alkoxy and amino, or R1 is pyridyl or pyridyl substituted with one or more substituents selected from alkyl, alkoxy and amino; R2 is optionally substituted alkyl, alkoxyalkyl, optionally substituted cycloalkylalkyl, arylalkyl, or R2 is arylalkyl substituted with one or more substituents selected from alkyl, alkoxy; X is -C(O)-, -C(O)-CH2-, -S(O)2-, or NH-C(O)- ; and A is optionally substituted alkyl or other substituents as defined in claim 1. Pharmaceutical compositions comprising such compounds, their preparation, and their pharmaceutical use in the treatment of disease states capable of being modulated by the inhibition of p38 kinase and/or tumor necrosis factor (TNF), such as asthma or joint inflammation.

  本发明提供了Formula (I)的化合物，其中( )是可选的乙烯桥；R1是烷基、环烷基、芳基或芳基，其上取代基可为烷基、烷氧基和氨基中的一种或多种，或者R1是吡啶基或吡啶基，其上取代基可为烷基、烷氧基和氨基中的一种或多种；R2是可选取代的烷基、烷氧基烷基、可选取代的环烷基烷基、芳基烷基，或者R2是芳基烷基，其上取代基可为烷基、烷氧基中的一种或多种；X是-C(O)-、-C(O)-CH2-、-S(O)2-或NH-C(O)-；A是可选取代的烷基或其他在权利要求1中定义的取代基。包括这些化合物的药物组合物、其制备以及在治疗能够通过抑制p38激酶和/或肿瘤坏死因子(TNF)调节的疾病状态中的药用，如哮喘或关节炎。
• Pyrazoles as inhibitors of tumor necrosis factor
  申请人：Borcherding R. David

  公开号：US20060063796A1

  公开（公告）日：2006-03-23

  The present invention provides compounds of Formula (I) and ester prodrugs, pharmaceutically acceptable salts or solvates of such compounds; or ester prodrugs of such salts or solvates; pharmaceutical compositions comprising such compounds, their preparation, and their pharmaceutical use in the treatment of disease states capable of being modulated by the inhibition of p38 kinase and/or tumor necrosis factor (TNF).

  本发明提供了式（I）的化合物和酯前药、这些化合物的药学上可接受的盐或溶剂；或这些盐或溶剂的酯前药；包括这些化合物的制药组合物，其制备以及它们在治疗能够通过抑制p38激酶和/或肿瘤坏死因子（TNF）调节的疾病状态中的药物应用。
• Method of inhibiting neurotrophin-receptor binding
  申请人：Ross Gregory M.

  公开号：US20090215814A1

  公开（公告）日：2009-08-27

  The present invention relates to compositions which inhibit the binding of nerve growth factor to the p75 NTR common neurotrophin receptor and methods of use thereof. In one embodiment, the compound which inhibits binding of nerve growth factor to p75 NTR comprises, particularly when bound to nerve growth factor, at least two of the following: (1) a first electronegative atom or functional group positioned to interact with Lys 34 of nerve growth factor; (2) a second electronegative atom or functional group positioned to interact with Lys 95 of nerve growth factor; (3) a third electronegative atom or functional group positioned to interact with Lys 88 of nerve growth factor; (4) a fourth electronegative atom or functional group positioned to interact with Lys 32 of nerve growth factor; and (5) a hydrophobic moiety which interacts with the hydrophobic region formed by Ile 31 , Phe 101 and Phe 86 of nerve growth factor.

  本发明涉及一种抑制神经生长因子与p75NTR共同神经营养因子受体结合的组合物及其使用方法。在一种实施方式中，抑制神经生长因子与p75NTR结合的化合物，尤其是当与神经生长因子结合时，至少包括以下两种：（1）第一电负原子或功能基，位于与神经生长因子的Lys34相互作用的位置；（2）第二电负原子或功能基，位于与神经生长因子的Lys95相互作用的位置；（3）第三电负原子或功能基，位于与神经生长因子的Lys88相互作用的位置；（4）第四电负原子或功能基，位于与神经生长因子的Lys32相互作用的位置；以及（5）与神经生长因子的Ile31、Phe101和Phe86形成的疏水区域相互作用的疏水基团。
• METHOD AND APPARATUS FOR MEASURING ENVIRONMENTAL ALLERGEN
  申请人：Japan Science and Technology Agency

  公开号：EP1712637A1

  公开（公告）日：2006-10-18

  A method for measuring an environmental allergen by which the allergen may be measured simply without using an anti-allergen antibody, as well as an instrument and apparatus therefor, is disclosed. In the method for measuring the environmental biological allergen, the biological allergen is measured by measuring the protease activity of the allergen. An instrument for measuring an environmental allergen(s) comprises a support and the substrate of the protease carried on the support, which substrate is used for the measurement of the protease activity of the allergen(s). The substrate is one which brings about fluorescence emission or change in absorption as a result of the enzyme reaction.

  本发明公开了一种测量环境过敏原的方法，通过这种方法可以不使用抗过敏原抗体而简单地测量过敏原，同时还公开了一种仪器和装置。在测量环境生物过敏原的方法中，通过测量过敏原的蛋白酶活性来测量生物过敏原。测量环境过敏原的仪器包括支架和支架上携带的蛋白酶底物，该底物用于测量过敏原的蛋白酶活性。底物是一种能在酶反应过程中产生荧光发射或吸收变化的物质。
• METHOD FOR DETERMINATION OF ALLERGEN IN ENVIRONMENT AND KIT FOR SIMPLE QUANTIFICATION OF ALLERGEN
  申请人：Japan Science and Technology Agency

  公开号：EP1953239A1

  公开（公告）日：2008-08-06

  A simple method for measuring allergens is disclosed, by which the amount of environmental allergens can be measured simply without using an anti-allergen antibody. In the method for measuring an environmental biological allergen(s), a solution containing a substrate of a protease which the allergen(s) has(have) is brought into contact with a test sample collected by using an adhesive sheet, which substrate gives a visible color change as a result of an enzyme reaction; and measuring the protease activity in the test sample using the color change of the substrate solution as an index, thereby measuring the biological allergen(s).

  本发明公开了一种测量过敏原的简便方法，通过这种方法，无需使用抗过敏原抗体，即可简单地测量环境过敏原的数量。在测量环境生物过敏原的方法中，将含有过敏原所具有的蛋白酶底物的溶液与使用胶片收集的测试样本接触，该底物会因酶反应而产生可见的颜色变化；以底物溶液的颜色变化为指标，测量测试样本中的蛋白酶活性，从而测量生物过敏原。