2-amino-3-(4-hydroxyphenyl)-N-methylpropanamide | 78891-97-1

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 2-amino-3-(4-hydroxyphenyl)-N-methylpropanamide
• CAS: 78891-97-1
• 化学式: C₁₀H₁₄N₂O₂
• 分子量: 194.23
• InChiKey: VRKUNXWBGNYJQG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.2
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  75.4
• 氢给体数：
  3
• 氢受体数：
  3

文献信息

• [EN] MU OPIOID RECEPTOR MODULATORS<br/>[FR] MODULATEURS DU RÉCEPTEUR OPIOÏDE DE TYPE MU
  申请人：UNIV CALIFORNIA

  公开号：WO2018129393A1

  公开（公告）日：2018-07-12

  Described herein, inter alia, are compositions and methods for modulating mu opioid receptor activity.

  本文描述了用于调节μ阿片受体活性的组合物和方法。
• [EN] INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF<br/>[FR] INHIBITEURS DE LA KALLIKRÉINE PLASMATIQUE ET UTILISATIONS ASSOCIÉES
  申请人：DYAX CORP

  公开号：WO2019028362A1

  公开（公告）日：2019-02-07

  Provided herein are compounds that inhibit pKal, a serine protease whose activity is responsible for proteolytically cleaving kininogen and generating the potent vasodilator and pro-inflammatory peptide bradykinin, which can lead to painful and debilitating inflammatory attacks (e.g., edema). Also provided are pharmaceutical compositions and kits comprising the compounds, and methods of treating pKal-related diseases and disorders (e.g., edema) with the compounds in a subject, by administering the compounds and/or compositions described herein.

  本文提供了抑制pKal的化合物，pKal是一种丝氨酸蛋白酶，其活性负责蛋白酶解切激肽原并生成强效的血管舒张剂和促炎肽布雷金因，这可能导致疼痛和令人痛苦的炎症发作（例如水肿）。还提供了包含这些化合物的药物组合物和试剂盒，以及使用这些化合物在受试者中治疗pKal相关疾病和紊乱（例如水肿）的方法，通过给予本文所述的化合物和/或组合物。
• Antiviral protease inhibitors
  申请人：Medivir AB

  公开号：US20010044547A1

  公开（公告）日：2001-11-22

  Compounds of formula (I), wherein A and A are independently the same or different group of formula (II) wherein: R′ is H, CH 3 , C(CH 3 ) 2 ,—OR a , —N(R a ) 2 , —N(R a )OR a or -DP; R is H or CH 3 ; R a is H, C 1 -C 3 alkyl; D is a bond, alkylene, —C(═O)—, —S(O)— or S(O) 2 —; P is an optionally substituted, mono or bicyclic carbo- or hetereocycle; R″ is H, any of the sidechains found in the natural amino acids, carboxacetamide, or a group (CH 2 ) n DP; M is a bond or —C(═O)N(R′″)-; Q is absent, a bond, —CH(OH)— or CH 2 —; or R″ together with Q, M and R define an optionally substituted 5 or 6 membered carbo- or heterocyclic ring which is optionally fused with a further 5 or 6 membered carbo- or heterocyclic ring; with the proviso that R is —OR a , -, N(R a ) 2 , —N(R a )OR a or -DP, if M is a bond and Q is absent; X is H, OH, OCH 3 , Y is H, OH, OCH 3 , but X and Y are not both H; Z′ and Z″ are independently —(CH 2 ) m P where P is as defined above; n and m are independently 0, 1 or 2; and pharmaceutically acceptable salts and prodrugs thereof have utility as aspartyl protease inhibitors of HIV. They can be prepared in a facile two step synthesis from novel 2,5-di-O-benzyl-L-mannaro-1,4:6,3-dilactone intermediates.

  化合物的式子（I），其中A和A独立地是式子（II）的相同或不同的基团，其中：R'是H，CH3，C（CH3）2，—ORa，—N（Ra）2，—N（Ra）ORa或-DP; R是H或CH3; Ra是H，C1-C3烷基; D是键，烷基，—C(═O)—，—S（O）—或S（O）2—; P是一个可选的取代的，单环或双环的碳或杂环；R″是H，天然氨基酸中发现的任何侧链，羧乙酰胺或一个组（CH2）nDP; M是键或—C(═O)N（R'″）-; Q不存在，是键，—CH（OH）—或CH2—; 或R″与Q、M和R一起定义一个可选的取代的5或6元环或杂环，该环可以与另一个可选的取代的5或6元环或杂环融合；条件是，如果M是键且Q不存在，则R是—ORa，-，N（Ra）2，—N（Ra）ORa或-DP；X是H，OH，OCH3，Y是H，OH，OCH3，但X和Y不都是H；Z′和Z″独立地是—（CH2）mP，其中P如上定义；n和m独立地是0、1或2；以及其药学上可接受的盐和前药具有作为HIV天冬氨酸蛋白酶抑制剂的用途。它们可以从新的2,5-二-O-苄基-L-曼纳罗-1,4:6,3-二内酯中间体中方便地进行两步合成。
• Tyrosine Bioconjugation through Aqueous Ene-Like Reactions
  申请人：Barbas, III Carlos F.

  公开号：US20120289682A1

  公开（公告）日：2012-11-15

  A new and versatile class of cyclic diazodicarboxamides that reacts efficiently and selectively with phenols and the phenolic side chain of tyrosine through an Ene-like reaction is reported. This mild aqueous tyrosine ligation reaction works over a broad pH range and expands the repertoire of aqueous chemistries available for small molecule, peptide, and protein modification. The tyrosine ligation reactions are shown to be compatible with the labeling of native enzymes and antibodies in buffered aqueous solution. This reaction provides a novel synthetic approach to bispecific antibodies. This reaction will find broad utility in peptide and protein chemistry and in the chemistry of phenol-containing compounds.

  报道了一种新型多功能环状二氮基二羧酰胺类化合物，通过Ene反应与苯酚和酪氨酸的苯基侧链高效选择性反应。这种温和的水相酪氨酸连接反应适用于广泛的pH范围，并扩展了小分子、肽和蛋白质修饰的水相化学反应库。该酪氨酸连接反应可与缓冲水溶液中的天然酶和抗体标记兼容。该反应提供了一种新的双特异性抗体合成方法。该反应将在肽和蛋白质化学以及含酚化合物的化学中发挥广泛的实用价值。
• MU opioid receptor modulators
  申请人：THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

  公开号：US10702498B2

  公开（公告）日：2020-07-07

  Described herein, inter alia, are compositions and methods for modulating mu opioid receptor activity.

  本文特别描述了调节μ阿片受体活性的组合物和方法。