5-Amino-2-methyl-1-naphthol | 116415-34-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 5-Amino-2-methyl-1-naphthol
• 英文别名: 5-Amino-2-methylnaphthalen-1-ol
• CAS: 116415-34-0
• 化学式: C₁₁H₁₁NO
• 分子量: 173.214
• InChiKey: ZGKXDPCCJIFSPA-UHFFFAOYSA-N

物化性质

• 熔点：
  160 °C
• 沸点：
  380.1±27.0 °C(Predicted)
• 密度：
  1.232±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  13
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  46.2
• 氢给体数：
  2
• 氢受体数：
  2

安全信息

• 储存条件：
  | 2-8°C |

反应信息

• 作为反应物：
  描述：

  5-Amino-2-methyl-1-naphthol 在 potassium dihydrogenphosphate 、 亚硝基硫酸 、 potassium nitrososulfonate 、 硫酸 、 水 作用下， 以 甲醇 、 水 为溶剂， 反应 8.0h， 生成 兰雪醌
  参考文献：
  名称：

  Moehrle, Hans; Folttmann, Hubertus, Zeitschrift fur Naturforschung, B: Chemical Sciences, 1987, vol. 42, # 12, p. 1578 - 1584

  摘要：

  DOI：
• 作为产物：
  描述：

  5-Amino-2-morpholinomethyl-1-naphthol 在 Ra-Ni-Al-alloy sodium hydroxide 作用下， 反应 2.0h， 以12%的产率得到5-Amino-2-methyl-1-naphthol
  参考文献：
  名称：

  Moehrle, Hans; Folttmann, Hubertus, Zeitschrift fur Naturforschung, B: Chemical Sciences, 1987, vol. 42, # 12, p. 1578 - 1584

  摘要：

  DOI：

文献信息

• Pyrimidinyl-pyridyloxy-naphthyl compounds and methods of treating IRE1-related diseases and disorders
  申请人：Genentech, Inc.

  公开号：US10968203B2

  公开（公告）日：2021-04-06

  Described herein are pyrimidinyl-pyridyloxy-naphthyl compounds with inositol requiring enzyme 1 (IRE1) modulation activity or function having the Formula I or I′ structure: or stereoisomers, tautomers, or pharmaceutically acceptable salts thereof, and with the substituents and structural features described herein. Also described are pharmaceutical compositions and medicaments that include the Formula I or I′ compounds, as well as methods of using such IRE1 modulators, alone and in combination with other therapeutic agents, for treating diseases or conditions that are mediated or dependent upon estrogen receptors.

  这里描述的是具有式 I 或 I′结构的嘧啶基吡啶氧基萘化合物，它们具有调节肌醇需要酶 1（IRE1）的活性或功能： 或其立体异构体、同系物或药学上可接受的盐，并具有本文所述的取代基和结构特征。还描述了包括式Ⅰ或Ⅰ′化合物的药物组合物和药物，以及单独或与其它治疗剂联合使用这种IRE1调节剂治疗由雌激素受体介导或依赖于雌激素受体的疾病或病症的方法。
• Development of a Chemical Toolset for Studying the Paralog-Specific Function of IRE1
  作者：Hannah C. Feldman、Venkata Narayana Vidadala、Zachary E. Potter、Feroz R. Papa、Bradley J. Backes、Dustin J. Maly

  DOI：10.1021/acschembio.9b00482

  日期：2019.12.20

  The dual kinase endoribonuclease IRE1 is a master regulator of cell fate decisions in cells experiencing endoplasmic reticulum (ER) stress. In mammalian cells, there are two paralogs of IRE1: IRE1 alpha and IRE1 beta. While IRE1 alpha has been extensively studied, much less is understood about IRE1 beta and its role in signaling. In addition, whether the regulation of IRE1 beta's enzymatic activities varies compared to IRE1 alpha is not known. Here, we show that the RNase domain of IRE1 beta is enzymatically active and capable of cleaving an XBP1 RNA mini-substrate in vitro. Using ATP-competitive inhibitors, we find that, like IRE1 alpha, there is an allosteric relationship between the kinase and RNase domains of IRE1 beta. This allowed us to develop a novel toolset of both paralog specific and dual-IRE1 alpha/beta kinase inhibitors that attenuate RNase activity (KIRAs). Using sequence alignments of IRE1 alpha and IRE1 beta, we propose a model for paralog-selective inhibition through interactions with nonconserved residues that differentiate the ATP-binding pockets of IRE1 alpha and IRE1 beta.
• MOHRLE, HANS;FOLTTMANN, HUBERTUS, Z. NATURFORSCH., 42,(1987) N 2, 1578-1584
  作者：MOHRLE, HANS、FOLTTMANN, HUBERTUS

  DOI：——

  日期：——
• Moehrle, Hans; Folttmann, Hubertus, Zeitschrift fur Naturforschung, B: Chemical Sciences, 1987, vol. 42, # 12, p. 1578 - 1584
  作者：Moehrle, Hans、Folttmann, Hubertus

  DOI：——

  日期：——