pyrimidine-2-carbaldehyde oxime | 83959-46-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: pyrimidine-2-carbaldehyde oxime
• 英文别名: N-(pyrimidin-2-ylmethylidene)hydroxylamine
• CAS: 83959-46-0
• 化学式: C₅H₅N₃O
• 分子量: 123.114
• InChiKey: IYKGJZGTTXURLS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  9
• 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：
  58.4
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  pyrimidine-2-carbaldehyde oxime 在 sodium hypochlorite 、 zinc diacetate 作用下， 以 异丙醇 为溶剂， 反应 17.0h， 生成 S-4-chloro-6-methoxy-2-{2-[3-(pyrimidin-2-yl)isoxazol-5-yl]pyrrolidin-1-yl}pyrimidine
  参考文献：
  名称：

  Development of an Efficient, Scalable Route for the Preparation of a Novel Insulin-Like Growth Factor-1 Receptor Modulator

  摘要：

  A chromatography-free and efficient synthesis of insulin-like growth factor-1 receptor (IGF-1R) modulator is reported. Herein we describe an improved synthesis for the target compound, which features facile introduction of a novel pyrrolidinyl-pyrimidyl isoxazole 8, via in situ sulfone displacement by fluorine. The overall process consists of six chemical steps and five isolations, with introduction of the expensive triheterocyclic unit 8 towards the end of the synthesis.

  DOI：

  10.1021/op300120r
• 作为产物：
  描述：

  2-(Diethoxymethyl)pyrimidine 在 盐酸羟胺 作用下， 生成 pyrimidine-2-carbaldehyde oxime
  参考文献：
  名称：

  Development of an Efficient, Scalable Route for the Preparation of a Novel Insulin-Like Growth Factor-1 Receptor Modulator

  摘要：

  A chromatography-free and efficient synthesis of insulin-like growth factor-1 receptor (IGF-1R) modulator is reported. Herein we describe an improved synthesis for the target compound, which features facile introduction of a novel pyrrolidinyl-pyrimidyl isoxazole 8, via in situ sulfone displacement by fluorine. The overall process consists of six chemical steps and five isolations, with introduction of the expensive triheterocyclic unit 8 towards the end of the synthesis.

  DOI：

  10.1021/op300120r

文献信息

• [EN] 4-(PYRAZOL-3-YLAMINO) PYRIMIDINE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER<br/>[FR] DERIVES DE 4-(PYRAZOL-3-YLAMINO) PYRIMIDINE QUI S'UTILISENT DANS LE TRAITEMENT DU CANCER
  申请人：ASTRAZENECA AB

  公开号：WO2005040159A1

  公开（公告）日：2005-05-06

  A compound of Formula (I); wherein the substituents are as defined in the text for use in modulating insulin-like growth factor 1 receptor activity in a warm blooded animal such as man.

  一种化合物，其化学式为（I）；其中取代基如文本中定义的那样，用于调节类胰岛素生长因子1受体在温血动物（如人类）中的活性。
• WO2006/100461
  申请人：——

  公开号：——

  公开（公告）日：——
• WO2006/109026
  申请人：——

  公开号：——

  公开（公告）日：——