N-(2-((4-chlorophenyl)(phenyl)methylamino)-2-oxoethyl)cyclopentanecarboxamide | 1089664-77-6

• 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: N-(2-((4-chlorophenyl)(phenyl)methylamino)-2-oxoethyl)cyclopentanecarboxamide
• 英文别名: N-[2-[[(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethyl]cyclopentanecarboxamide
• CAS: 1089664-77-6
• 化学式: C₂₁H₂₃ClN₂O₂
• 分子量: 370.879
• InChiKey: ZQSUXBCZQKUSDE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  26
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  58.2
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  rac-2-氨基-N-[(4-氯苯基)苯基甲基]乙酰胺盐酸盐 、 alkaline earth salt of/the/ methylsulfuric acid 生成 N-(2-((4-chlorophenyl)(phenyl)methylamino)-2-oxoethyl)cyclopentanecarboxamide
  参考文献：
  名称：

  Design, synthesis and structure–activity relationship of simple bis-amides as potent inhibitors of GlyT1

  摘要：

  Several novel classes of potent and small amide-type inhibitors of glycine transport (GlyT1) were developed through sequential simplification of a benzodiazepinone-lead structure identified from a high-throughput screening. The most potent compounds of these structurally simple classes show low nanomolar inhibition at the GlyT1 target. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.09.005