2-(5,6,7,8-四氢萘-1-基)乙酰胺 | 13052-98-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 四氢化萘
• 中文名称: 2-(5,6,7,8-四氢萘-1-基)乙酰胺
• 英文名称: (5,6,7,8-tetrahydro-[1]naphthyl)-acetic acid amide
• 英文别名: (5,6,7,8-Tetrahydro-[1]naphthyl)-essigsaeure-amid；1-Naphthaleneacetamide, 5,6,7,8-tetrahydro-；2-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
• CAS: 13052-98-7
• 化学式: C₁₂H₁₅NO
• 分子量: 189.257
• InChiKey: HOXDVJHMSBALCX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  43.1
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  吲哚-3-乙醛酸甲酯 、 2-(5,6,7,8-四氢萘-1-基)乙酰胺 在 potassium tert-butylate 作用下， 以 四氢呋喃 为溶剂， 生成
  参考文献：
  名称：

  Aryl[ a ]pyrrolo[3,4- c ]carbazoles as selective cyclin D1-CDK4 inhibitors

  摘要：

  The synthesis of new analogues of Arcyriaflavin A in which one indole ring is replaced by an aryl or heteroaryl ring is described. These new series of aryl[a]pyrrolo[3,4-c]carbazoles were evaluated as inhibitors of Cyclin D1-CDK4. A potent and selective D1-CDK4 inhibitor, 7a (D1-CDK4 IC50=45 nM), has been identified. The potency, selectivity profile against other kinases, and structure-activity relationship (SAR) trends of this class of compounds are discussed. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(03)00791-1
• 作为产物：
  描述：

  草酸二乙酯 、 alkaline earth salt of/the/ methylsulfuric acid 在 乙醚 、 乙醇 、 sodium 作用下， 生成 2-(5,6,7,8-四氢萘-1-基)乙酰胺
  参考文献：
  名称：

  Tanaka; Miyaji, Takeda Kenkyusho Nenpo, 1949, vol. 8, p. 29,40

  摘要：

  DOI：

文献信息

• Aryl[ a ]pyrrolo[3,4- c ]carbazoles as selective cyclin D1-CDK4 inhibitors
  作者：Concha Sanchez-Martinez、Chuan Shih、Margaret M. Faul、Guoxin Zhu、Michael Paal、Carmen Somoza、Tiechao Li、Christine A. Kumrich、Leonard L. Winneroski、Zhou Xun、Harold B. Brooks、Bharvin K.R. Patel、Richard M. Schultz、Tammy B. DeHahn、Charles D. Spencer、Scott A. Watkins、Eileen Considine、Jack A. Dempsey、Catherine A. Ogg、Robert M. Campbell、Bryan A. Anderson、Jill Wagner

  DOI：10.1016/s0960-894x(03)00791-1

  日期：2003.11

  The synthesis of new analogues of Arcyriaflavin A in which one indole ring is replaced by an aryl or heteroaryl ring is described. These new series of aryl[a]pyrrolo[3,4-c]carbazoles were evaluated as inhibitors of Cyclin D1-CDK4. A potent and selective D1-CDK4 inhibitor, 7a (D1-CDK4 IC50=45 nM), has been identified. The potency, selectivity profile against other kinases, and structure-activity relationship (SAR) trends of this class of compounds are discussed. (C) 2003 Elsevier Ltd. All rights reserved.
• Tanaka; Miyaji, Takeda Kenkyusho Nenpo, 1949, vol. 8, p. 29,40
  作者：Tanaka、Miyaji

  DOI：——

  日期：——