• 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

16-甲基-11-(2-甲基苯基)-14-苯基-8,12-二氧杂-14,15-二氮杂四环-[8.7.0.0(2,7).0(13,17)]十七碳-2(7),3,5,13(17),15-五烯-10-甲腈

16-Methyl-11-(2-methyl-phen-yl)-14-phenyl-8,12-dioxa-14,15-di-aza-tetra-cyclo-[8.7.0.0(2,7).0(13,17)]hepta-deca-2(7),3,5,13(17),15-penta-ene-10-carbo-nitrile.

作者信息

Kanchanadevi Jeevanandam, Anbalagan Gopalakrishnan, Kannan Damodharan, Bakthadoss Manickam, Manivannan Vadivelu

机构信息

Department of Physics, Velammal Institute of Technology, Panchetty, Chennai 601 204, India.

Department of Physics, Presidency College (Autonomous), Chennai 600 005, India.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2013 Nov 6;69(Pt 12):o1746. doi: 10.1107/S1600536813029905.

DOI:10.1107/S1600536813029905
PMID:24454201
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3885026/
Abstract

In the title compound, C28H23N3O2, the pyrazole ring makes a dihedral angle of 16.90 (6)° with the phenyl ring to which it is attached. Both di-hydro-pyran rings exhibit half-chair conformations. Intramolecular C-H⋯O interactions generate S(6) and S(8) ring motifs. In the crystal, weak C-H⋯O and C-H⋯π interactions occur.

摘要

在标题化合物C28H23N3O2中,吡唑环与其相连的苯环形成16.90 (6)°的二面角。两个二氢吡喃环均呈现半椅式构象。分子内C-H⋯O相互作用产生S(6)和S(8)环模式。在晶体中,存在弱C-H⋯O和C-H⋯π相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7f40/3885026/730873443b90/e-69-o1746-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7f40/3885026/b60413ecbba7/e-69-o1746-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7f40/3885026/730873443b90/e-69-o1746-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7f40/3885026/b60413ecbba7/e-69-o1746-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7f40/3885026/730873443b90/e-69-o1746-fig2.jpg

相似文献

1
16-Methyl-11-(2-methyl-phen-yl)-14-phenyl-8,12-dioxa-14,15-di-aza-tetra-cyclo-[8.7.0.0(2,7).0(13,17)]hepta-deca-2(7),3,5,13(17),15-penta-ene-10-carbo-nitrile.16-甲基-11-(2-甲基苯基)-14-苯基-8,12-二氧杂-14,15-二氮杂四环-[8.7.0.0(2,7).0(13,17)]十七碳-2(7),3,5,13(17),15-五烯-10-甲腈
Acta Crystallogr Sect E Struct Rep Online. 2013 Nov 6;69(Pt 12):o1746. doi: 10.1107/S1600536813029905.
2
Methyl 11,14,16-triphenyl-8,12-dioxa-14,15-di-aza-tetra-cyclo-[8.7.0.0(2,7).0(13,17)]hepta-deca-2(7),3,5,13(17),15-penta-ene-10-carboxyl-ate.11,14,16-三苯基-8,12-二氧杂-14,15-二氮杂四环-[8.7.0.0(2,7).0(13,17)]十七碳-2(7),3,5,13(17),15-五烯-10-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2013 Jun 8;69(Pt 7):o1035. doi: 10.1107/S1600536813015213. eCollection 2013.
3
Crystal structure of methyl 6-meth-oxy-11-(4-meth-oxy-phen-yl)-16-methyl-14-phenyl-8,12-dioxa-14,15-di-aza-tetra-cyclo-[8.7.0.0(2,7).0(13,17)]hepta-deca-2(7),3,5,13(17),15-penta-ene-10-carboxyl-ate.6-甲氧基-11-(4-甲氧基苯基)-16-甲基-14-苯基-8,12-二氧杂-14,15-二氮杂四环-[8.7.0.0(2,7).0(13,17)]十七碳-2(7),3,5,13(17),15-五烯-10-羧酸甲酯的晶体结构
Acta Crystallogr Sect E Struct Rep Online. 2014 Aug 9;70(Pt 9):127-9. doi: 10.1107/S1600536814017929. eCollection 2014 Sep 1.
4
17-(Pyrimidin-2-yl)-8,16-dioxa-17-aza-tetra-cyclo-[7.7.1.0.0]hepta-deca-2,4,6,10,12,14-hexa-ene.17 -(嘧啶 - 2 - 基)- 8,16 - 二氧杂 - 17 - 氮杂 - 四环 - [7.7.1.0.0]十七碳 - 2,4,6,10,12,14 - 六烯
Acta Crystallogr Sect E Struct Rep Online. 2012 Feb 1;68(Pt 2):o440. doi: 10.1107/S1600536812000931. Epub 2012 Jan 18.
5
8-Bromo-3-(4-ethyl-phen-yl)-1-phenyl-3,3a,4,9b-tetra-hydro-1H-chromeno[4,3-c]isoxazole-3a-carbo-nitrile.8-溴-3-(4-乙基苯基)-1-苯基-3,3a,4,9b-四氢-1H-色烯并[4,3-c]异恶唑-3a-甲腈
Acta Crystallogr Sect E Struct Rep Online. 2013 Sep 12;69(Pt 10):o1533. doi: 10.1107/S1600536813023982. eCollection 2013.
6
Crystal structure of 2-benzyl-amino-4-(4-meth-oxy-phen-yl)-6,7,8,9-tetra-hydro-5H-cyclo-hepta-[b]pyridine-3-carbo-nitrile.2-苄基氨基-4-(4-甲氧基苯基)-6,7,8,9-四氢-5H-环庚并[b]吡啶-3-甲腈的晶体结构
Acta Crystallogr Sect E Struct Rep Online. 2014 Nov 19;70(Pt 12):525-7. doi: 10.1107/S1600536814024878. eCollection 2014 Dec 1.
7
Crystal structures of 2-benzyl-amino-4-(4-bromo-phen-yl)-6,7,8,9-tetra-hydro-5H-cyclo-hepta-[b]pyridine-3-carbo-nitrile and 2-benzyl-amino-4-(4-chloro-phen-yl)-6,7,8,9-tetra-hydro-5H-cyclo-hepta[b]pyridine-3-carbo-nitrile.2-苄基氨基-4-(4-溴苯基)-6,7,8,9-四氢-5H-环庚并[b]吡啶-3-甲腈和2-苄基氨基-4-(4-氯苯基)-6,7,8,9-四氢-5H-环庚并[b]吡啶-3-甲腈的晶体结构
Acta Crystallogr E Crystallogr Commun. 2015 Jan 1;71(Pt 1):12-5. doi: 10.1107/S2056989014025936.
8
Crystal structures of three 1-oxo-1,2-di-hydro-naphthalene derivatives: dimethyl 4-(4-meth-oxy-phen-yl)-2-(4-methyl-phen-yl)-1-oxo-1,2-di-hydro-naphthalene-2,3-di-carboxyl-ate, dimethyl 1-oxo-2-(pyren-4-yl)-4-(thio-phen-2-yl)-1,2-di-hydro-naphthalene-2,3-di-carboxyl-ate and ethyl 1-oxo-2-phenyl-2,4-bis-(thio-phen-2-yl)-1,2-di-hydro-naphthalene-3-carboxyl-ate.三种1-氧代-1,2-二氢萘衍生物的晶体结构:4-(4-甲氧基苯基)-2-(4-甲基苯基)-1-氧代-1,2-二氢萘-2,3-二羧酸二甲酯、1-氧代-2-(芘-4-基)-4-(噻吩-2-基)-1,2-二氢萘-2,3-二羧酸二甲酯和1-氧代-2-苯基-2,4-双(噻吩-2-基)-1,2-二氢萘-3-羧酸乙酯。
Acta Crystallogr E Crystallogr Commun. 2017 Jan 13;73(Pt 2):177-182. doi: 10.1107/S2056989017000469. eCollection 2017 Feb 1.
9
2,9,12,15,18,25,27,34,37,40,43,50-Dodeca-oxa-56-aza-hepta-cyclo-[24.24.5.1(51,55).0(3,8).0(19,24).0(28,33).0(44,49)]hexa-penta-conta-3,5,7,19(24),20,22,28(33),29,31,44,46,48,51,53,55-penta-deca-ene.2,9,12,15,18,25,27,34,37,40,43,50-十二氧杂-56-氮杂-七环-[24.24.5.1(51,55).0(3,8).0(19,24).0(28,33).0(44,49)]六戊环-[3,5,7,19(24),20,22,28(33),29,31,44,46,48,51,53,55]-十五碳烯
Acta Crystallogr Sect E Struct Rep Online. 2012 Oct 1;68(Pt 10):o2913. doi: 10.1107/S1600536812038093. Epub 2012 Sep 12.
10
Methyl 12-hydroxy-10-[1-(4-meth-oxy-phen-yl)-2-oxo-3-phen-oxy-azetidin-4-yl]-11-oxa-3-aza-hexa-cyclo-[11.7.1.0(2,9).0(2,12).0(3,7).0(17,21)]henicosa-1(20),13,15,17(21),18-penta-ene-9-carboxyl-ate.12-羟基-10-[1-(4-甲氧基苯基)-2-氧代-3-苯氧基氮杂环丁烷-4-基]-11-氧杂-3-氮杂二十六环-[11.7.1.0(2,9).0(2,12).0(3,7).0(17,21)]二十一碳-1(20),13,15,17(21),18-五烯-9-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2012 Dec 1;68(Pt 12):o3329-30. doi: 10.1107/S1600536812045795. Epub 2012 Nov 10.

引用本文的文献

1
Crystal structure of methyl 6-meth-oxy-11-(4-meth-oxy-phen-yl)-16-methyl-14-phenyl-8,12-dioxa-14,15-di-aza-tetra-cyclo-[8.7.0.0(2,7).0(13,17)]hepta-deca-2(7),3,5,13(17),15-penta-ene-10-carboxyl-ate.6-甲氧基-11-(4-甲氧基苯基)-16-甲基-14-苯基-8,12-二氧杂-14,15-二氮杂四环-[8.7.0.0(2,7).0(13,17)]十七碳-2(7),3,5,13(17),15-五烯-10-羧酸甲酯的晶体结构
Acta Crystallogr Sect E Struct Rep Online. 2014 Aug 9;70(Pt 9):127-9. doi: 10.1107/S1600536814017929. eCollection 2014 Sep 1.

本文引用的文献

1
Methyl 11,14,16-triphenyl-8,12-dioxa-14,15-di-aza-tetra-cyclo-[8.7.0.0(2,7).0(13,17)]hepta-deca-2(7),3,5,13(17),15-penta-ene-10-carboxyl-ate.11,14,16-三苯基-8,12-二氧杂-14,15-二氮杂四环-[8.7.0.0(2,7).0(13,17)]十七碳-2(7),3,5,13(17),15-五烯-10-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2013 Jun 8;69(Pt 7):o1035. doi: 10.1107/S1600536813015213. eCollection 2013.
2
(6bS*,14R*,14aR*)-Methyl 14-(4-methyl-phen-yl)-7-oxo-6b,6c,7,12b,14,14a-hexa-hydro-1H-pyrano[3,2-c:5,4-c']dichromene-14a-carboxyl-ate.(6bS*,14R*,14aR*)-14-(4-甲基苯基)-7-氧代-6b,6c,7,12b,14,14a-六氢-1H-吡喃并[3,2-c:5,4-c']二色烯-14a-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2013 Feb 1;69(Pt 2):o267-8. doi: 10.1107/S1600536813001244. Epub 2013 Jan 19.
3
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.
4
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.
5
A chemical genetics approach for the discovery of apoptosis inducers: from phenotypic cell based HTS assay and structure-activity relationship studies, to identification of potential anticancer agents and molecular targets.一种用于发现细胞凋亡诱导剂的化学遗传学方法:从基于细胞表型的高通量筛选分析和构效关系研究,到潜在抗癌药物和分子靶点的鉴定。
Curr Med Chem. 2006;13(22):2627-44. doi: 10.2174/092986706778201521.
6
Benzo-gamma-pyrone analogues of geiparvarin: synthesis and biological evaluation against B16 melanoma cells.
Anticancer Drug Des. 1993 Oct;8(5):349-60.