2-phenylaminosulfonylmethyl-5-phenylsulfonylmethyl-1,3,4-thiadiazole | 1246440-80-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-phenylaminosulfonylmethyl-5-phenylsulfonylmethyl-1,3,4-thiadiazole
• 英文别名: 1-[5-(benzenesulfonylmethyl)-1,3,4-thiadiazol-2-yl]-N-phenylmethanesulfonamide
• CAS: 1246440-80-1
• 化学式: C₁₆H₁₅N₃O₄S₃
• 分子量: 409.511
• InChiKey: BWCHFPBEGWMKLI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  26
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  151
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  2-phenylaminosulfonylmethyl-5-phenylsulfonylmethyl-1,3,4-oxadiazole 在 硫脲 作用下， 以 四氢呋喃 为溶剂， 以73%的产率得到2-phenylaminosulfonylmethyl-5-phenylsulfonylmethyl-1,3,4-thiadiazole
  参考文献：
  名称：

  Synthesis and bioassay of aminosulfonyl-1,3,4-oxadiazoles and their interconversion to 1,3,4-thiadiazoles

  摘要：

  A new class of oxadiazoles is prepared by treating aminosulfonylacetic acids with different carboxylic acid hydrazides. Interconversion of oxadiazoles to thiadiazoles is carried out with thiourea. The compounds are screened for antimicrobial and antioxidant activities. (C) 2010 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2010.06.022

文献信息

• Synthesis and bioassay of aminosulfonyl-1,3,4-oxadiazoles and their interconversion to 1,3,4-thiadiazoles
  作者：V. Padmavathi、S. Nagi Reddy、G. Dinneswara Reddy、A. Padmaja

  DOI：10.1016/j.ejmech.2010.06.022

  日期：2010.9

  A new class of oxadiazoles is prepared by treating aminosulfonylacetic acids with different carboxylic acid hydrazides. Interconversion of oxadiazoles to thiadiazoles is carried out with thiourea. The compounds are screened for antimicrobial and antioxidant activities. (C) 2010 Elsevier Masson SAS. All rights reserved.