6-羟基烟酰肼 | 134531-63-8

• 物质功能分类: 有机原料 - 肼或胲的有机衍生物
• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 中文名称: 6-羟基烟酰肼
• 中文别名: 6-羟基异烟酸酰肼；6-羟基烟酸酰肼
• 英文名称: 6-hydroxynicotinic acid hydrazide
• 英文别名: 6-Hydroxy-nicotinsaeure-hydrazid；6-Oxo-1,6-dihydropyridine-3-carboxylic acid hydrazide；6-oxo-1H-pyridine-3-carbohydrazide
• CAS: 134531-63-8
• 化学式: C₆H₇N₃O₂
• mdl: MFCD10698665
• 分子量: 153.14
• InChiKey: CWZHFIGWRBBYJC-UHFFFAOYSA-N

物化性质

• 密度：
  1.382±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -1.5
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  84.2
• 氢给体数：
  3
• 氢受体数：
  3

安全信息

• 海关编码：
  2933399090
• 危险性防范说明：
  P261,P305+P351+P338
• 危险性描述：
  H302,H315,H319,H335

反应信息

• 作为反应物：
  描述：

  6-羟基烟酰肼 、 4-羟基-1-萘甲醛 以 二甲基亚砜 为溶剂， 以88%的产率得到6-Hydroxy-nicotinic acid [1-(4-hydroxy-naphthalen-1-yl)-meth-(E)-ylidene]-hydrazide
  参考文献：
  名称：

  Identification of Alkylidene Hydrazides as Glucagon Receptor Antagonists

  摘要：

  High throughput screening of our small molecule combinatorial library identified a class of benzoylnaphthalenehydrazones with modest affinity for the human glucagon receptor. Optimization of this initial hit through a series of targeted libraries and traditional medicinal chemistry led to ligands with nanomolar affinities. Pharmacological evaluation demonstrated that these ligands were competitive glucagon receptor antagonists. Intravenous administration of a representative benzoylnaphthalenehydrazone into rats attenuated glucagon-stimulated glucose levels.

  DOI：

  10.1021/jm000547o
• 作为产物：
  描述：

  6-羟基烟酸甲酯 在 肼 作用下， 以 乙醇 为溶剂， 反应 1.0h， 以82%的产率得到6-羟基烟酰肼
  参考文献：
  名称：

  Identification of Alkylidene Hydrazides as Glucagon Receptor Antagonists

  摘要：

  High throughput screening of our small molecule combinatorial library identified a class of benzoylnaphthalenehydrazones with modest affinity for the human glucagon receptor. Optimization of this initial hit through a series of targeted libraries and traditional medicinal chemistry led to ligands with nanomolar affinities. Pharmacological evaluation demonstrated that these ligands were competitive glucagon receptor antagonists. Intravenous administration of a representative benzoylnaphthalenehydrazone into rats attenuated glucagon-stimulated glucose levels.

  DOI：

  10.1021/jm000547o

文献信息

• Mills; Widdows, Journal of the Chemical Society, 1908, vol. 93, p. 1379
  作者：Mills、Widdows

  DOI：——

  日期：——
• Identification of Alkylidene Hydrazides as Glucagon Receptor Antagonists
  作者：Anthony Ling、Yufeng Hong、Javier Gonzalez、Vlad Gregor、Alex Polinsky、Atsuo Kuki、Shenghua Shi、Kimberly Teston、Douglas Murphy、John Porter、Dan Kiel、James Lakis、Kenna Anderes、John May、Lotte Bjerre Knudsen、Jesper Lau

  DOI：10.1021/jm000547o

  日期：2001.9.1

  High throughput screening of our small molecule combinatorial library identified a class of benzoylnaphthalenehydrazones with modest affinity for the human glucagon receptor. Optimization of this initial hit through a series of targeted libraries and traditional medicinal chemistry led to ligands with nanomolar affinities. Pharmacological evaluation demonstrated that these ligands were competitive glucagon receptor antagonists. Intravenous administration of a representative benzoylnaphthalenehydrazone into rats attenuated glucagon-stimulated glucose levels.