3-(2,3-dihydro-1H-inden-2-yl)propanoyl chloride | 856691-77-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 茚满类
• 英文名称: 3-(2,3-dihydro-1H-inden-2-yl)propanoyl chloride
• CAS: 856691-77-5
• 化学式: C₁₂H₁₃ClO
• 分子量: 208.688
• InChiKey: KWYYECGILIRMAK-UHFFFAOYSA-N

物化性质

• 沸点：
  304.0±11.0 °C(Predicted)
• 密度：
  1.152±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  3-(2,3-dihydro-1H-inden-2-yl)propanoyl chloride 、 (S)-4-异丙基-2-唑烷酮 在 正丁基锂 作用下， 以 四氢呋喃 为溶剂， 以77%的产率得到
  参考文献：
  名称：

  Identification of a novel class of succinyl-nitrile-based Cathepsin S inhibitors

  摘要：

  The synthesis and in vitro activities of a series of suceinyl-nitrile-based inhibitors of Cathepsin S are described. Several members of this class show nanomolar inhibition of the target enzyme as well as cellular potency. The inhibitors displaying the greatest potency contain N-alkyl substituted piperidine and pyrrolidine rings spiro-fused to the alpha-carbon of the P1 residue. (C) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2007.02.046
• 作为产物：
  描述：

  3-(2-indanyl)propionic acid 在 草酰氯 作用下， 以 二氯甲烷 为溶剂， 以43%的产率得到3-(2,3-dihydro-1H-inden-2-yl)propanoyl chloride
  参考文献：
  名称：

  Identification of a novel class of succinyl-nitrile-based Cathepsin S inhibitors

  摘要：

  The synthesis and in vitro activities of a series of suceinyl-nitrile-based inhibitors of Cathepsin S are described. Several members of this class show nanomolar inhibition of the target enzyme as well as cellular potency. The inhibitors displaying the greatest potency contain N-alkyl substituted piperidine and pyrrolidine rings spiro-fused to the alpha-carbon of the P1 residue. (C) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2007.02.046

文献信息

• Indane or dihydroindole derivatives
  申请人：H. Lundbeck A/S

  公开号：US06352988B2

  公开（公告）日：2002-03-05

  The present invention relates to substituted indane or dihydroindole compounds of Formula (I) wherein A is an indole. These compounds have high affinity for D4 receptors.

  本发明涉及式（I）中A为吲哚的取代茚烷或二氢吲哚化合物。这些化合物对D4受体具有高亲和力。
• Compounds having lysophosphatidic acid receptor antagonism and uses thereof
  申请人：Tanaka Motoyuki

  公开号：US20070149595A1

  公开（公告）日：2007-06-28

  The present invention relates to a compound represented by formula (I): (wherein the symbols in formula were described in the description), a salt thereof, a solvate thereof or a prodrug thereof. Since the compound of the present invention binds to and is antagonistic to an LPA receptor (particularly, EDG-2), it is useful for prevention and/or treatment of urinary system disease (prostatic hypertrophy or neurogenic bladder dysfunction disease, spinal cord neoplasm, nucleous hernia, spinal canal stenosis, diseases caused by diabetes, occlusion disease of lower urinary tract, inflammatory disease of lower urinary tract, and polyuria), carcinoma-associated disease, proliferative disease, inflammation system disease, immune system disease, disease by secretory dysfunction, brain-related disease and/or chronic disease.

  本发明涉及一种由式(I)表示的化合物：（其中式中的符号在说明中被描述），其盐，溶剂化物或前药。由于本发明的化合物与LPA受体（特别是EDG-2）结合并具有拮抗作用，因此它对预防和/或治疗泌尿系统疾病（前列腺增生或神经源性膀胱功能障碍疾病，脊髓肿瘤，核突出，脊柱管狭窄，由糖尿病引起的疾病，下尿路梗阻疾病，下尿路炎症性疾病和多尿症），癌症相关疾病，增殖性疾病，炎症系统疾病，免疫系统疾病，分泌功能障碍疾病，与大脑相关的疾病和/或慢性疾病具有用处。
• COMPOUNDS HAVING LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISM AND USES THEREOF
  申请人：ONO PHARMACEUTICAL CO., LTD.

  公开号：EP1695955B1

  公开（公告）日：2011-10-12
• US7875745B2
  申请人：——

  公开号：US7875745B2

  公开（公告）日：2011-01-25
• Identification of a novel class of succinyl-nitrile-based Cathepsin S inhibitors
  作者：Younes Bekkali、David S. Thomson、Raj Betageri、Michel J. Emmanuel、Ming-Hong Hao、Eugene Hickey、Weimin Liu、Usha Patel、Yancey D. Ward、Erick R.R. Young、Richard Nelson、Alison Kukulka、Maryanne L. Brown、Kathy Crane、Della White、Dorothy M. Freeman、Mark E. Labadia、Jessi Wildeson、Denice M. Spero

  DOI：10.1016/j.bmcl.2007.02.046

  日期：2007.5

  The synthesis and in vitro activities of a series of suceinyl-nitrile-based inhibitors of Cathepsin S are described. Several members of this class show nanomolar inhibition of the target enzyme as well as cellular potency. The inhibitors displaying the greatest potency contain N-alkyl substituted piperidine and pyrrolidine rings spiro-fused to the alpha-carbon of the P1 residue. (C) 2007 Elsevier Ltd. All rights reserved.