2-Benzylsulfanyl-5-pyridin-2-yl-1,3,4-oxadiazole | 197371-76-9

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 2-Benzylsulfanyl-5-pyridin-2-yl-1,3,4-oxadiazole
• CAS: 197371-76-9
• 化学式: C₁₄H₁₁N₃OS
• 分子量: 269.327
• InChiKey: IGKIGLCECYLVRB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  77.1
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2-Benzylsulfanyl-5-pyridin-2-yl-1,3,4-oxadiazole 在 间氯过氧苯甲酸 作用下， 以 二氯甲烷 为溶剂， 生成 2-Benzylsulfinyl-5-pyridin-2-yl-1,3,4-oxadiazole
  参考文献：
  名称：

  Novel inhibitors of cell adhesion molecule expression

  摘要：

  2-Alkylsulfinyl-1,3,4-oxadiazoles have been identified as novel inhibitors of cell adhesion molecule expression on endothelial cells. These compounds have been shown to inhibit the up-regulation of ELAM-1 and VCAM-1 on activated human umbilical vein endothelial cells (HUVECs) as measured by ELISA. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/s0960-894x(96)00504-5
• 作为产物：
  描述：

  2-吡啶甲酰肼 在 氢氧化钾 、 potassium carbonate 作用下， 以 乙醇 、 丙酮 为溶剂， 生成 2-Benzylsulfanyl-5-pyridin-2-yl-1,3,4-oxadiazole
  参考文献：
  名称：

  Novel inhibitors of cell adhesion molecule expression

  摘要：

  2-Alkylsulfinyl-1,3,4-oxadiazoles have been identified as novel inhibitors of cell adhesion molecule expression on endothelial cells. These compounds have been shown to inhibit the up-regulation of ELAM-1 and VCAM-1 on activated human umbilical vein endothelial cells (HUVECs) as measured by ELISA. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/s0960-894x(96)00504-5

文献信息

• COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS
  申请人：THE BROAD INSTITUTE, INC.

  公开号：US20160031870A1

  公开（公告）日：2016-02-04

  Disclosed are compounds that can be used for treating tuberculosis.

  本发明涉及用于治疗结核病的化合物。
• Compounds for the treatment of tuberculosis
  申请人：THE BROAD INSTITUTE, INC.

  公开号：US10301294B2

  公开（公告）日：2019-05-28

  Disclosed are compounds that can be used for treating tuberculosis.

  所公开的是可用于治疗结核病的化合物。
• [EN] COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS<br/>[FR] COMPOSÉS POUR LE TRAITEMENT DE LA TUBERCULOSE
  申请人：BROAD INST INC

  公开号：WO2014165090A1

  公开（公告）日：2014-10-09

  Disclosed are compounds that can be used for treating tuberculosis.
• Novel inhibitors of cell adhesion molecule expression
  作者：Dharmpal S. Dodd、Zhongqi Shen、Takao Nishi、Norma Graber、Dawson Bealls、Miranda Fong、Tracy Ebert

  DOI：10.1016/s0960-894x(96)00504-5

  日期：1996.11

  2-Alkylsulfinyl-1,3,4-oxadiazoles have been identified as novel inhibitors of cell adhesion molecule expression on endothelial cells. These compounds have been shown to inhibit the up-regulation of ELAM-1 and VCAM-1 on activated human umbilical vein endothelial cells (HUVECs) as measured by ELISA. Copyright (C) 1996 Elsevier Science Ltd