6-methyl-1-tosyl-4,5,6,7-tetrahydro-1H-indole | 1449115-04-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 6-methyl-1-tosyl-4,5,6,7-tetrahydro-1H-indole
• 英文别名: 6-Methyl-1-(4-methylphenyl)sulfonyl-4,5,6,7-tetrahydroindole；6-methyl-1-(4-methylphenyl)sulfonyl-4,5,6,7-tetrahydroindole
• CAS: 1449115-04-1
• 化学式: C₁₆H₁₉NO₂S
• 分子量: 289.398
• InChiKey: CVIWTHSRMSGFAH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.16
• 重原子数：
  20.0
• 可旋转键数：
  2.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  39.07
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  4-甲基环己酮 在 吡啶 、 copper(ll) sulfate pentahydrate 、 bis{rhodium[3,3'-(1,3-phenylene)bis(2,2-dimethylpropanoic acid)]} 、 sodium ascorbate 、 三氯氧磷 作用下， 以 四氢呋喃 、 水 、 1,2-二氯乙烷 、 甲苯 为溶剂， 反应 39.0h， 生成 6-methyl-1-tosyl-4,5,6,7-tetrahydro-1H-indole
  参考文献：
  名称：

  FUSED PYRROLYL-SULFONAMIDE COMPOUNDS

  摘要：

  The present invention relates to a compound of formula (I), or a tautomer, a stereoisomer, a hydrate, a solvate, a polymorph, a prodrug, an isotope, or a co-crystal thereof, or a pharmaceutically acceptable salt thereof, (I) wherein A, R1, and R2are as defined in the description and claims. The present invention also relates to a pharmaceutical composition comprising a compound according to the invention, and a pharmaceutical acceptable carrier. The present invention also relates to the present compounds for use as a medicine and/or as diagnostics. The present invention also relates to the present compounds for use in the prevention and/or treatment of GPR17 mediated disorders, such as for example a disorder or syndrome selected from a myelination disorder and a disorder or syndrome associated with brain tissue damage.

  公开号：

  WO2024115733A1

文献信息

• Conversion of Cyclic Ketones to 2,3-Fused Pyrroles and Substituted Indoles
  作者：Joshua S. Alford、Jillian E. Spangler、Huw M. L. Davies

  DOI：10.1021/ja405043g

  日期：2013.8.14

  A highly effective synthesis of 2,3-fused pyrroles from cyclic ketones has been achieved. The transformation includes a rhodium-catalyzed reaction of 4-alkenyl-1-sulfonyl-1,2,3-triazoles featuring an unusual 4π electrocyclization. The methodology was further extended to the synthesis of indoles using a one-pot reaction starting from 1-ethynylcyclohexenes.

  已经实现了由环酮高效合成 2,3-稠合吡咯。该转化包括 4-链烯基-1-磺酰基-1,2,3-三唑的铑催化反应，具有不寻常的 4π 电环化。该方法进一步扩展到使用从 1-乙炔基环己烯开始的一锅反应合成吲哚。