10-(hydroxymethyl)-5-methoxy-4-methyl-1H-chromeno[3,4-f]quinolin-2(5H)-one | 1041643-00-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异喹啉及其衍生物
• 英文名称: 10-(hydroxymethyl)-5-methoxy-4-methyl-1H-chromeno[3,4-f]quinolin-2(5H)-one
• CAS: 1041643-00-8
• 化学式: C₁₉H₁₇NO₄
• 分子量: 323.348
• InChiKey: OQPGUYZQGWUQIG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.03
• 重原子数：
  24.0
• 可旋转键数：
  2.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  71.55
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为产物：
  描述：

  甲醇 、 5-hydroxy-10-(hydroxymethyl)-4-methyl-1H-chromeno[3,4-f]quinolin-2(5H)-one 在 对甲苯磺酸 作用下， 以95%的产率得到10-(hydroxymethyl)-5-methoxy-4-methyl-1H-chromeno[3,4-f]quinolin-2(5H)-one
  参考文献：
  名称：

  Discovery of a novel series of nonsteroidal androgen receptor modulators: 5- or 6-oxachrysen-2-ones

  摘要：

  A novel oxachrysenone series (2) of nonsteroidal selective androgen receptor modulators (SARM) was developed based on the 6-aryl-2-quinolinones (1). Synthesis and preliminary SAR results based on in vitro assays are discussed. In the cotransfection assay, lead compound 5d showed AR agonist activity more potent than dihydrotestosterone (DHT), whereas compound 17b was a potent antagonist similar to bicalutamide. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.03.085