6-(4-isopropylpiperazine-1-carbonyl)pyridine-3-carbaldehyde | 866327-64-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 6-(4-isopropylpiperazine-1-carbonyl)pyridine-3-carbaldehyde
• 英文别名: 6-(4-Isopropyl-piperazine-1-carbonyl)-pyridine-3-carbaldehyde；6-(4-propan-2-ylpiperazine-1-carbonyl)pyridine-3-carbaldehyde
• CAS: 866327-64-2
• 化学式: C₁₄H₁₉N₃O₂
• 分子量: 261.324
• InChiKey: MXEVMAPKQPLVOW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  53.5
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  哌啶 、 6-(4-isopropylpiperazine-1-carbonyl)pyridine-3-carbaldehyde 在 三乙酰氧基硼氢化钠 作用下， 以 二氯甲烷 为溶剂， 反应 18.0h， 以9%的产率得到(4-isopropylpiperazin-1-yl)-(5-(piperidin-1-yl)methylpyridin-2-yl)methanone
  参考文献：
  名称：

  Non-Imidazole heterocyclic compounds

  摘要：

  某些非咪唑杂环化合物是组胺H3调节剂，可用于治疗组胺H3受体介导的疾病。

  公开号：

  US20050222151A1
• 作为产物：
  描述：

  (5-hydroxymethylpyridin-2-yl)-(4-isopropylpiperazin-1-yl)methanone 在 二氧化锰 作用下， 以 二氯甲烷 为溶剂， 反应 6.0h， 以to give the desired aldehyde (0.250 g, 95%)的产率得到6-(4-isopropylpiperazine-1-carbonyl)pyridine-3-carbaldehyde
  参考文献：
  名称：

  Pyridine compounds as histamine H3 modulators

  摘要：

  某些非咪唑杂环化合物是组胺H3受体调节剂，用于治疗组胺H3受体介导的疾病。

  公开号：

  US07423147B2

文献信息

• [EN] AMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE<br/>[FR] DERIVES AMIDIQUES INHIBITEURS DE L'HISTONE DEACETYLASE
  申请人：ANGELETTI P IST RICHERCHE BIO

  公开号：WO2006005941A1

  公开（公告）日：2006-01-19

  The present invention relates to ketone derivatives that are inhibitors of histone deacetylase (HDAC). The compounds of the present invention are useful for treating cellular proliferative diseases, including cancer. Further, the compounds of the present invention are useful for treating neurodegenerative diseases, schizophrenia and stroke among other diseases.

  本发明涉及一种抑制组蛋白去乙酰化酶（HDAC）的酮衍生物。本发明的化合物对治疗细胞增殖性疾病，包括癌症，具有用处。此外，本发明的化合物对治疗神经退行性疾病、精神分裂症和中风等疾病也具有用处。
• Isoxazole Compounds as Histamine H3 modulators
  申请人：Carruthers Nicholas I.

  公开号：US20100022539A1

  公开（公告）日：2010-01-28

  Certain isoxazole compounds are histamine H 3 modulators useful in the treatment of histamine H 3 receptor mediated diseases.

  某些异唑啉化合物是组胺H3调节剂，可用于治疗组胺H3受体介导的疾病。
• NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS
  申请人：Carruthers Nicholas I.

  公开号：US20080306066A1

  公开（公告）日：2008-12-11

  Certain non-imidazole heterocyclic compounds are histamine H 3 modulators useful in the treatment of histamine H 3 receptor mediated diseases.

  某些非咪唑杂环化合物是组胺H3调节剂，可用于治疗组胺H3受体介导的疾病。
• Heterocyclic replacement of the central phenyl core of diamine-based histamine H3 receptor antagonists
  作者：Devin M. Swanson、Chandra R. Shah、Brian Lord、Kirsten Morton、Lisa K. Dvorak、Curt Mazur、Richard Apodaca、Wei Xiao、Jamin D. Boggs、Mark Feinstein

  DOI：10.1016/j.ejmech.2009.06.007

  日期：2009.11

  A series of small molecules consisting of a heterocyclic core flanked by two basic functionalities were synthesized and screened for in vitro affinity at the human histamine H-3 receptor (hH(3)R). Nine of the twenty-eight compounds tested were found to possess a hH(3)R K-i of less than 5 nM and consisted of a diverse range of central hetero-aromatic linkers (pyridine, pyrazine, oxazole, isoxazole, thiazole, furan, thiophene, and pyrrole). One member of this series, (4-isopropyl-piperazin-1-yl)-(6-piperidin-1-ylmethyl-pyridin-3-yl)-methanone (37), was found to be a high affinity, selective antagonist that crosses the blood-brain barrier and occupies H-3 receptors after oral administration in the rat. (C) 2009 Elsevier Masson SAS. All rights reserved.
• AMIDE DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE
  申请人：ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A.

  公开号：EP1768955A1

  公开（公告）日：2007-04-04