4-Hydroxy-5-acetyl-2,6-diphenyl-pyrimidin | 20954-87-4

• 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: 4-Hydroxy-5-acetyl-2,6-diphenyl-pyrimidin
• 英文别名: 5-acetyl-2,6-diphenyl-3H-pyrimidin-4-one；5-Acetyl-2,6-diphenylpyrimidin-4(1H)-one；5-acetyl-2,4-diphenyl-1H-pyrimidin-6-one
• CAS: 20954-87-4
• 化学式: C₁₈H₁₄N₂O₂
• 分子量: 290.321
• InChiKey: GTKGKDRGSSQGSK-UHFFFAOYSA-N

物化性质

• 熔点：
  297 °C (decomp)
• 沸点：
  481.3±55.0 °C(Predicted)
• 密度：
  1.20±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  58.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  6-甲基-2-苯基-1,3-恶嗪-4-酮 以53%的产率得到
  参考文献：
  名称：

  YAMAMOTO YAMAMOTO; AZUMA YUTAKA; KATO TETSUKO, HETEROCYCLES, 1977, 6, NO 9-10, 1610-1615

  摘要：

  DOI：

文献信息

• YAMAMOTO Y.; AZUMA Y., HETEROCYCLES, 1977, 6, NO 11, 1817-1820
  作者：YAMAMOTO Y.、 AZUMA Y.

  DOI：——

  日期：——
• COMPOSITIONS AND METHODS FOR INHIBITING N-SMASE2
  申请人：BILOUSOVA Tina

  公开号：US20200270216A1

  公开（公告）日：2020-08-27

  Provided herein are compounds of Formula (I) and (II) and their salts, and compositions comprising such compounds that are useful for useful for modulating neutral sphingomyelinase 2 (n-SMase2) in cells. Also disclosed herein are methods of using the disclosed compounds and compositions for inhibiting the spread of Tau seeds from donor cells to recipient cells. Moreover, disclosed herein are methods of using the disclosed compounds and compositions for treating or preventing a neurodegenerative disorder, such as a tauopathy, Alzheimer's disease (AD), Parkinson's disease (PD), Huntington's disease (HD), Lewy body dementia, frontotemporal dementia, and amyotrophic lateral sclerosis (ALS).