• 文献检索
  • 文档翻译
  • 深度研究
  • 学术资讯
  • Suppr Zotero 插件Zotero 插件
  • 邀请有礼
  • 套餐&价格
  • 历史记录
应用&插件
Suppr Zotero 插件Zotero 插件浏览器插件Mac 客户端Windows 客户端微信小程序
定价
高级版会员购买积分包购买API积分包
服务
文献检索文档翻译深度研究API 文档MCP 服务
关于我们
关于 Suppr公司介绍联系我们用户协议隐私条款
关注我们

Suppr 超能文献

核心技术专利：CN118964589B侵权必究
粤ICP备2023148730 号-1Suppr @ 2026

文献检索

告别复杂PubMed语法，用中文像聊天一样搜索，搜遍4000万医学文献。AI智能推荐，让科研检索更轻松。

立即免费搜索

文件翻译

保留排版，准确专业，支持PDF/Word/PPT等文件格式，支持 12+语言互译。

免费翻译文档

深度研究

AI帮你快速写综述，25分钟生成高质量综述，智能提取关键信息，辅助科研写作。

立即免费体验

2,3-二溴-3-(4-溴苯基)-1-[3-(4-甲氧基苯基)-4-亚胺基-1,2,4-恶二唑-5(4H)-酮基]丙烷-1-酮

2,3-Dibromo-3-(4-bromo-phen-yl)-1-[3-(4-meth-oxy-phen-yl)sydnon-4-yl]propan-1-one.

作者信息

Fun Hoong-Kun, Hemamalini Madhukar, Kalluraya Balakrishna

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Apr 1;67(Pt 4):o951. doi: 10.1107/S1600536811010002. Epub 2011 Mar 23.

DOI:10.1107/S1600536811010002
PMID:21754217
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3099938/
Abstract

In the title compound {systematic name: 4-[2,3-dibromo-3-(4-bromo-phen-yl)propano-yl]-3-(4-meth-oxy-phen-yl)-1,2,3-oxa-dia-zol-3-ylium-5-olate}, C(18)H(13)Br(3)N(2)O(4), the central oxadiazole ring, which is essentially planar with a maximum deviation of 0.016 (3) Å, makes dihedral angles of 29.98 (16) and 52.04 (16)°, respectively, with the terminal bromo-substituted and meth-oxy-substituted benzene rings. An intra-molecular C-H⋯O hydrogen bond generates an S(6) ring motif.

摘要

在标题化合物{系统名称：4-[2,3-二溴-3-(4-溴苯基)丙酰基]-3-(4-甲氧基苯基)-1,2,3-恶二唑-3-鎓-5-醇盐}，C(18)H(13)Br(3)N(2)O(4)中，中心恶二唑环基本呈平面状，最大偏差为0.016 (3) Å，分别与末端溴取代和甲氧基取代的苯环形成29.98 (16)°和52.04 (16)°的二面角。分子内C-H⋯O氢键形成一个S(6)环模式。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90c1/3099938/20bc5b73d64c/e-67-0o951-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90c1/3099938/b01fba7f39f1/e-67-0o951-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90c1/3099938/20bc5b73d64c/e-67-0o951-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90c1/3099938/b01fba7f39f1/e-67-0o951-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90c1/3099938/20bc5b73d64c/e-67-0o951-fig2.jpg

相似文献

1
2,3-Dibromo-3-(4-bromo-phen-yl)-1-[3-(4-meth-oxy-phen-yl)sydnon-4-yl]propan-1-one.2,3-二溴-3-(4-溴苯基)-1-[3-(4-甲氧基苯基)-4-亚胺基-1,2,4-恶二唑-5(4H)-酮基]丙烷-1-酮
Acta Crystallogr Sect E Struct Rep Online. 2011 Apr 1;67(Pt 4):o951. doi: 10.1107/S1600536811010002. Epub 2011 Mar 23.
2
2,3-Dibromo-3-phenyl-1-(3-phenyl-sydnon-4-yl)propan-1-one.2,3-二溴-3-苯基-1-(3-苯基-4-亚甲基异恶唑-5-酮基)丙-1-酮
Acta Crystallogr Sect E Struct Rep Online. 2011 Apr 1;67(Pt 4):o814. doi: 10.1107/S1600536811008026. Epub 2011 Mar 9.
3
2,3-Dibromo-3-(2-bromo-phen-yl)-1-(3-phenyl-sydnon-4-yl)propan-1-one.2,3-二溴-3-(2-溴苯基)-1-(3-苯基-4-亚胺基异恶唑啉-5-酮基)丙烷-1-酮
Acta Crystallogr Sect E Struct Rep Online. 2010 Nov 6;66(Pt 12):o3094. doi: 10.1107/S1600536810044776.
4
4-[2,3-Dibromo-3-(4-bromo-phen-yl)propano-yl]-2-phenyl-1,2,3-oxadiazol-2-ium-5-olate.4-[2,3-二溴-3-(4-溴苯基)丙酰基]-2-苯基-1,2,3-恶二唑-2-鎓-5-醇盐
Acta Crystallogr Sect E Struct Rep Online. 2010 Oct 20;66(Pt 11):o2818-9. doi: 10.1107/S1600536810040493.
5
4-({[4-Amino-5-(4-chloro-anilinometh-yl)-4H-1,2,4-triazol-3-yl]sulfan-yl}acet-yl)-3-(4-meth-oxy-phen-yl)-1,2,3-oxadiazol-3-ium-5-olate.4 - {[4 - 氨基 - 5 -（4 - 氯苯胺甲基）- 4H - 1,2,4 - 三唑 - 3 - 基]硫烷基}乙酰基 - 3 -（4 - 甲氧基苯基）- 1,2,3 - 恶二唑 - 3 - 鎓 - 5 - 醇盐
Acta Crystallogr Sect E Struct Rep Online. 2010 Nov 13;66(Pt 12):o3178. doi: 10.1107/S1600536810046155.
6
4-Bromo-N-(4-meth-oxy-2-nitro-phen-yl)benzamide.4-溴-N-(4-甲氧基-2-硝基苯基)苯甲酰胺
Acta Crystallogr Sect E Struct Rep Online. 2012 Apr 1;68(Pt 4):o1234. doi: 10.1107/S1600536812010963. Epub 2012 Mar 31.
7
4-[3-(Phen-oxy-meth-yl)-7H-1,2,4-triazolo[3,4-b][1,3,4]thia-diazin-6-yl]-3-(p-tol-yl)sydnone.4-[3-(苯氧基甲基)-7H-1,2,4-三唑并[3,4-b][1,3,4]噻二嗪-6-基]-3-(对甲苯基) sydnone
Acta Crystallogr Sect E Struct Rep Online. 2010 Jul 31;66(Pt 8):o2178-9. doi: 10.1107/S1600536810029910.
8
1-(2-Meth-oxy-phen-yl)-2-{[2-(2-meth-oxy-phen-yl)hydrazinyl-idene](nitro)-meth-yl}diazene.1-（2-甲氧基苯基）-2-{[2-（2-甲氧基苯基）肼叉基]（硝基）甲基}重氮烯
Acta Crystallogr Sect E Struct Rep Online. 2012 Mar 1;68(Pt 3):o609. doi: 10.1107/S1600536812004175. Epub 2012 Feb 4.
9
4-(4-Bromo-phen-yl)-1-(2,6-difluoro-benz-yl)-3-(3,4,5-trimeth-oxy-phen-yl)-1H-1,2,4-triazole-5(4H)-thione.4-（4-溴苯基）-1-（2,6-二氟苄基）-3-（3,4,5-三甲氧基苯基）-1H-1,2,4-三唑-5（4H）-硫酮
Acta Crystallogr Sect E Struct Rep Online. 2012 Jan;68(Pt 1):o89. doi: 10.1107/S1600536811052330. Epub 2011 Dec 10.
10
3-(4-Chloro-phen-oxy)-1-(4-meth-oxy-phen-yl)-4-(4-nitro-phen-yl)azetidin-2-one.3-（4-氯苯氧基）-1-（4-甲氧基苯基）-4-（4-硝基苯基）氮杂环丁烷-2-酮
Acta Crystallogr Sect E Struct Rep Online. 2011 May 1;67(Pt 5):o1101-2. doi: 10.1107/S1600536811013018. Epub 2011 Apr 13.

本文引用的文献

1
Structure validation in chemical crystallography.化学晶体学中的结构验证
Acta Crystallogr D Biol Crystallogr. 2009 Feb;65(Pt 2):148-55. doi: 10.1107/S090744490804362X. Epub 2009 Jan 20.
2
Synthesis and antimicrobial activities of a new series of 4-S-[4(1)-amino-5(1)-oxo-6(1)-substituted benzyl-4(1),5(1)-dihydro-1(1),2(1),4(1)-triazin-3-yl]mercaptoacetyl-3-arylsydnones.一系列新型4-S-[4(1)-氨基-5(1)-氧代-6(1)-取代苄基-4(1),5(1)-二氢-1(1),2(1),4(1)-三嗪-3-基]巯基乙酰基-3-芳基斯德酮的合成与抗菌活性
Eur J Med Chem. 2008 Dec;43(12):2831-4. doi: 10.1016/j.ejmech.2008.02.003. Epub 2008 Mar 4.
3
A short history of SHELX.
SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.
4
Convenient access to 1,3,4-trisubstituted pyrazoles carrying 5-nitrothiophene moiety via 1,3-dipolar cycloaddition of sydnones with acetylenic ketones and their antimicrobial evaluation.通过Sydnones与炔酮的1,3-偶极环加成反应便捷合成含5-硝基噻吩部分的1,3,4-三取代吡唑及其抗菌活性评价
Eur J Med Chem. 2008 Aug;43(8):1715-20. doi: 10.1016/j.ejmech.2007.08.002. Epub 2007 Aug 30.