[5-(4-chlorophenyl)-3,3-dimethyl-1,1-dioxo-2,3-dihydroisothiazol-4-ylmethyl]ethylamine | 416855-48-6

• 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: [5-(4-chlorophenyl)-3,3-dimethyl-1,1-dioxo-2,3-dihydroisothiazol-4-ylmethyl]ethylamine
• 英文别名: N-(5-(4-chlorophenyl)-3,3-dimethyl-1,1-dioxo-2,3-dihydroisothiazol-4-yl)methyl-N-ethylamine；5-(4-Chlorophenyl)-4-ethylaminomethyl-3,3-dimethyl-2,3-dihydroisothiazol 1,1-dioxide；N-[[5-(4-chlorophenyl)-3,3-dimethyl-1,1-dioxo-2H-1,2-thiazol-4-yl]methyl]ethanamine
• CAS: 416855-48-6
• 化学式: C₁₄H₁₉ClN₂O₂S
• 分子量: 314.836
• InChiKey: AEPDNJKNJBBNGP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  20
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  66.6
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  [5-(4-chlorophenyl)-3,3-dimethyl-1,1-dioxo-2,3-dihydroisothiazol-4-ylmethyl]ethylamine 在 1-羟基苯并三唑 、 N,N'-二环己基碳二亚胺 、 三氟乙酸 作用下， 以 二氯甲烷 、 醋酸异丙酯 、 水 为溶剂， 生成
  参考文献：
  名称：

  Structure activity studies of the serine-AIB dipeptide domain in 2,3-dihydroisothiazole based growth hormone secretagogues

  摘要：

  A series of growth hormone secretagogues (GHSs) based on 2,3-dihydroisothiazole has been synthesized in the search for a potential treatment of growth hormone deficiency or frailty in the elderly. This paper describes the evaluation of the SAR of the benzyl-D-Ser-aminoisobutyric acid dipeptide fragment. Introduction of substituents in the peptide backbone and in the phenyl ring has been investigated, as well as replacements for the benzyl group and for the AIB residue. A number of modifications resulted in enhanced potency over the parent benzyl-D-Ser-AIB derivative. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2005.07.070
• 作为产物：
  描述：

  4-bromomethyl-5-(4-chlorophenyl)-3,3-dimethyl-1,1-dioxo-2,3-dihydro-isothiazole 、 乙胺 以 乙醇 、 水 为溶剂， 反应 24.0h， 生成 [5-(4-chlorophenyl)-3,3-dimethyl-1,1-dioxo-2,3-dihydroisothiazol-4-ylmethyl]ethylamine
  参考文献：
  名称：

  [EN] DIPEPTIDIC GROWTH HORMONE SECRETAGOGUES
  [FR] SECRETAGOGUES D'HORMONE DE CROISSANCE

  摘要：

  公开号：

  WO2003087069A3

文献信息

• Substituted dipeptides as growth hormone secretagogues
  申请人：——

  公开号：US20040058971A1

  公开（公告）日：2004-03-25

  This invention relates to novel compounds which are useful in the modulation of endogenous growth hormone levels in a mammal. The invention further relates to novel intermediates for usein the synthesis of said compounds, as well as novel processes employed in these syntheses. Also included are methods of treating a mammal which include the administration of said compounds.

  这项发明涉及一种新颖的化合物，可用于调节哺乳动物体内生长激素水平。该发明还涉及用于合成这些化合物的新颖中间体，以及用于这些合成过程的新颖方法。还包括治疗哺乳动物的方法，其中包括给予这些化合物的管理。
• Growth hormone secretagogues
  申请人：Evers Britta

  公开号：US20050240001A1

  公开（公告）日：2005-10-27

  This invention relates to novel compounds which are useful in the modulation of endogenous growth hormone levels in a mammal. The invention further relates to novel intermediates for use in the synthesis of said compounds, as well as novel processes employed in these syntheses. Also included are methods of treating a mammal which include the administration of said compounds.

  本发明涉及一种新型化合物，该化合物在哺乳动物内调节内源性生长激素水平方面具有有用的作用。本发明还涉及用于合成所述化合物的新型中间体，以及用于这些合成的新型工艺。此外，还包括包括给予所述化合物的治疗哺乳动物的方法。
• SUBSTITUTED DIPEPTIDES AS GROWTH HORMONE SECRETAGOGUES
  申请人：ELI LILLY AND COMPANY

  公开号：EP1326851B1

  公开（公告）日：2004-06-30
• GROWTH HORMONE SECRETAGOGUES
  申请人：ELI LILLY AND COMPANY

  公开号：EP1497316A2

  公开（公告）日：2005-01-19
• DIPEPTIDIC GROWTH HORMONE SECRETAGOGUES
  申请人：ELI LILLY AND COMPANY

  公开号：EP1497317B1

  公开（公告）日：2006-09-06