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N-propyl-2,3-dihydro-1H-indene-2-carboxamide | 1313588-39-4

中文名称
——
中文别名
——
英文名称
N-propyl-2,3-dihydro-1H-indene-2-carboxamide
英文别名
——
N-propyl-2,3-dihydro-1H-indene-2-carboxamide化学式
CAS
1313588-39-4
化学式
C13H17NO
mdl
——
分子量
203.284
InChiKey
IBPFHMBIICBYIS-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    2.4
  • 重原子数:
    15
  • 可旋转键数:
    3
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.46
  • 拓扑面积:
    29.1
  • 氢给体数:
    1
  • 氢受体数:
    1

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    N-propyl-2,3-dihydro-1H-indene-2-carboxamide劳森试剂mercury(II) diacetate 作用下, 以 甲苯 为溶剂, 反应 2.0h, 生成 3-(2,3-dihydro-1H-inden-2-yl)-4-propyl-1,2,4-triazole
    参考文献:
    名称:
    Optimization of triazoles as novel and potent nonphlorizin SGLT2 inhibitors
    摘要:
    Previous efforts have led to the identification of a potent, selective, and nonphlorizin based SGLT2 inhibitor 1. This Letter describes efforts to further optimize the potency, microsomal stability, solubility and pharmacokinetic properties of this series of SGLT2 inhibitors. From these efforts, compounds 28 and 32 have improved solubility and pharmacokinetic properties compared to compound 1 (C) 2011 Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.bmcl.2011.04.053
  • 作为产物:
    描述:
    正丙胺2-茚羧酸氯化亚砜N,N-二甲基甲酰胺 作用下, 以 二氯甲烷 为溶剂, 以80%的产率得到N-propyl-2,3-dihydro-1H-indene-2-carboxamide
    参考文献:
    名称:
    Optimization of triazoles as novel and potent nonphlorizin SGLT2 inhibitors
    摘要:
    Previous efforts have led to the identification of a potent, selective, and nonphlorizin based SGLT2 inhibitor 1. This Letter describes efforts to further optimize the potency, microsomal stability, solubility and pharmacokinetic properties of this series of SGLT2 inhibitors. From these efforts, compounds 28 and 32 have improved solubility and pharmacokinetic properties compared to compound 1 (C) 2011 Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.bmcl.2011.04.053
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文献信息

  • QUINUCLIDINE DERIVATIVES BINDING TO MUCARINIC M3 RECEPTORS
    申请人:Collingwood Stephen Paul
    公开号:US20100041887A1
    公开(公告)日:2010-02-18
    Compounds of formula I in salt or zwitterionic form wherein, wherein R 1 , R 2 , R 3 , and R 4 have the meanings as indicated in the specification, are useful for treating conditions that are mediated by the muscarinic M3 receptor. Pharmaceutical compositions that contain the compounds and a process for preparing the compounds are also described.
    具有式I的化合物,其以盐或双离子形式存在,其中R1、R2、R3和R4的含义如规范中所示,可用于治疗由肌肉乙酰胆碱M3受体介导的疾病。还描述了含有这些化合物的制药组合物和制备这些化合物的过程。
  • Quinuclidine derivatives binding to mucarinic m3 receptors
    申请人:Collingwood Paul Stephen
    公开号:US20070060563A1
    公开(公告)日:2007-03-15
    Compounds of formula I in salt or zwitterionic form wherein, wherein R 1 , R 2 , R 3 , and R 4 have the meanings as indicated in the specification, are useful for treating conditions that are mediated by the muscarinic M3 receptor. Pharmaceutical compositions that contain the compounds and a process for preparing the compounds are also described.
    具有式I的盐或双电离形式的化合物,其中R1、R2、R3和R4的含义如规范中所示,可用于治疗由肌肉型M3受体介导的病症。还描述了含有这些化合物的制药组合物和制备这些化合物的过程。
  • US8168654B2
    申请人:——
    公开号:US8168654B2
    公开(公告)日:2012-05-01
  • Optimization of triazoles as novel and potent nonphlorizin SGLT2 inhibitors
    作者:Xiaohui Du、Mike Lizarzaburu、Simon Turcotte、Taeweon Lee、Joanne Greenberg、Bei Shan、Peter Fan、Yun Ling、Julio C. Medina、Jonathan Houze
    DOI:10.1016/j.bmcl.2011.04.053
    日期:2011.6
    Previous efforts have led to the identification of a potent, selective, and nonphlorizin based SGLT2 inhibitor 1. This Letter describes efforts to further optimize the potency, microsomal stability, solubility and pharmacokinetic properties of this series of SGLT2 inhibitors. From these efforts, compounds 28 and 32 have improved solubility and pharmacokinetic properties compared to compound 1 (C) 2011 Elsevier Ltd. All rights reserved.
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