2-amino-1-(3-chloro-thiophen-2-yl)-ethanone hydrochloride | 349494-97-9

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-amino-1-(3-chloro-thiophen-2-yl)-ethanone hydrochloride
• 英文别名: 2-amino-1-(3-chlorothien-2-yl)ethanone hydrochloride；2-(3-Chloro-thiophen-2-yl)-2-oxo-1-ethylamine hydrochloride；2-amino-1-(3-chlorothiophen-2-yl)ethanone;hydrochloride
• CAS: 349494-97-9
• 化学式: C₆H₆ClNOS*ClH
• 分子量: 212.1
• InChiKey: DLENOFYRKYLCSU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.17
• 重原子数：
  11
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  73
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-amino-1-(3-chloro-thiophen-2-yl)-ethanone hydrochloride 、 1-乙基-3-甲基-4-硝基-1H-吡唑-5-羧酸 以0.32 g (76%)的产率得到5-(3-Chloro-thiophen-2-yl)-1-ethyl-3-methyl-6,7-dihydro-1H-pyrazolo[4,3-e][1,4]diazepin-8-one
  参考文献：
  名称：

  Novel substituted pyrazolo[4,3-e]diazepines, pharmaceutical compositions containing them, use as medicinal products and processes for preparing them

  摘要：

  这项发明涉及一种新型的取代吡唑并[4,3-e]-二氮杂环庚烷的一般式(I)，以及含有它们的药物组合物，它们作为药物的用途以及制备它们的方法。

  公开号：

  US20030171364A1

文献信息

• Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof
  申请人：——

  公开号：US20030045546A1

  公开（公告）日：2003-03-06

  The present invention is directed to substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs thereof, represented by the Formula I: 1 wherein Ar 1 , Ar 3 , A, B and D are defined herein. The present invention also relates to the discovery that compounds having Formula I are activators of caspases and inducers of apoptosis. Therefore, the activators of caspases and inducers of apoptosis of this invention may be used to induce cell death in a variety of clinical conditions in which uncontrolled growth and spread of abnormal cells occurs.

  本发明涉及取代的3-芳基-5-芳基-[1,2,4]-噁二唑及其类似物，由以下式I表示： 1 其中Ar1，Ar3，A，B和D在此处定义。本发明还涉及发现具有式I的化合物是caspase的激活剂和凋亡诱导剂。因此，本发明的caspase激活剂和凋亡诱导剂可用于诱导在各种临床病况中发生未受控制的异常细胞生长和扩散的细胞死亡。
• Novel substituted pyrazolo[4,3-e]diazepines, pharmaceutical compositions containing them, use as medical products and processes for preparing them
  申请人：Burnouf Catherine

  公开号：US20050130957A1

  公开（公告）日：2005-06-16

  The invention relates to novel substituted pyrazolo[4,3-e]-diazepines of general formula: to pharmaceutical compositions containing them, to their use as medicinal products and to processes for preparing them.

  本发明涉及一种新的取代的嘧唑并[4,3-e]-二氮杂环己烷通式：以及含有它们的制药组合物，它们作为药物的使用以及制备它们的过程。
• Method of using substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof
  申请人：Cytovia, Inc.

  公开号：US07435750B2

  公开（公告）日：2008-10-14

  The present invention is directed to substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs thereof, represented by the Formula I: wherein Ar1, Ar3, A, B and D are defined herein. The present invention also relates to the discovery that compounds having Formula I are activators of caspases and inducers of apoptosis. Therefore, the activators of caspases and inducers of apoptosis of this invention may be used to induce cell death in a variety of clinical conditions in which uncontrolled growth and spread of abnormal cells occurs.

  本发明涉及被公式I所代表的取代的3-芳基-5-芳基-[1,2,4]-噁二唑及其类似物，其中Ar1、Ar3、A、B和D在此被定义。本发明还涉及发现具有公式I的化合物是caspase的激活剂和凋亡诱导剂。因此，本发明的caspase激活剂和凋亡诱导剂可用于在各种临床病症中诱导细胞死亡，其中出现了异常细胞的不受控制的生长和扩散。
• NOVEL SUBTITUTED PYRAZOLO[4,3-e]DIAZEPINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, USE AS MEDICINAL PRODUCTS AND PROCESSES FOR PREPARING THEM
  申请人：Warner-Lambert Company LLC

  公开号：EP1248787B1

  公开（公告）日：2004-10-06
• SUBSTITUTED 3-ARYL-5-ARYL- 1,2,4]-OXADIAZOLES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF
  申请人：Cytovia, Inc.

  公开号：EP1406632A2

  公开（公告）日：2004-04-14