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（2E）-3-（4-氯苯基）-1-（2,4-二甲基喹啉-3-基）丙-2-烯-1-酮

(2E)-3-(4-Chloro-phen-yl)-1-(2,4-dimethyl-quinolin-3-yl)prop-2-en-1-one.

作者信息

Prasath R, Bhavana P, Ng Seik Weng, Tiekink Edward R T

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Apr 1;67(Pt 4):o796-7. doi: 10.1107/S1600536811007835. Epub 2011 Mar 5.

DOI:10.1107/S1600536811007835
PMID:21754086
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3099908/
Abstract

Two independent mol-ecules comprise the asymmetric unit of the title compound, C(20)H(16)ClNO, which differ in the orientation of the chalcone residue with respect to the quinoline ring [the C-C-C(=O)-C torsion angles are 69.5 (2) and 86.0 (2)°]. The configuration about each of the ethyl-ene bonds [1.342 (2) and 1.338 (2) Å] is E. The three-dimensional crystal structure is stabilized by a combination of C-H⋯O, C-H⋯N, C-H⋯π inter-actions and π-π contacts between the independent mol-ecules [Cg(C(6) of quinoline)⋯Cg(C(6) of quinoline) = 3.6719 (11) Å].

摘要

标题化合物C(20)H(16)ClNO的不对称单元由两个独立分子组成，查尔酮残基相对于喹啉环的取向不同[C-C-C(=O)-C扭转角分别为69.5 (2)°和86.0 (2)°]。每个乙烯键[键长分别为1.342 (2)和1.338 (2) Å]的构型均为E型。三维晶体结构通过独立分子之间的C-H⋯O、C-H⋯N、C-H⋯π相互作用以及π-π接触得以稳定[喹啉的Cg(C(6))⋯喹啉的Cg(C(6)) = 3.6719 (11) Å]。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9bdb/3099908/409d23184051/e-67-0o796-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9bdb/3099908/f09d88118b55/e-67-0o796-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9bdb/3099908/2badbe935a43/e-67-0o796-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9bdb/3099908/de90c77bf0ac/e-67-0o796-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9bdb/3099908/409d23184051/e-67-0o796-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9bdb/3099908/f09d88118b55/e-67-0o796-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9bdb/3099908/2badbe935a43/e-67-0o796-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9bdb/3099908/de90c77bf0ac/e-67-0o796-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9bdb/3099908/409d23184051/e-67-0o796-fig4.jpg

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本文引用的文献

1
(2E)-3-(4-Bromo-phen-yl)-1-(2-methyl-4-phenyl-3-quinol-yl)prop-2-en-1-one.（2E）-3-（4-溴苯基）-1-（2-甲基-4-苯基-3-喹啉基）丙-2-烯-1-酮
Acta Crystallogr Sect E Struct Rep Online. 2010 Apr 17;66(Pt 5):o1110. doi: 10.1107/S1600536810013784.
2
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.
3
Qmol: a program for molecular visualization on Windows-based PCs.Qmol：一款用于在基于Windows的个人电脑上进行分子可视化的程序。
J Mol Graph Model. 2001;19(6):557-9, 609. doi: 10.1016/s1093-3263(01)00090-0.
4
Bioactivities of chalcones.查耳酮的生物活性。
Curr Med Chem. 1999 Dec;6(12):1125-49.
5
Synthesis and pharmacological properties of some quinoline derivatives.
Farmaco. 1998 Jun 30;53(6):399-404. doi: 10.1016/s0014-827x(98)00037-8.
6
Antiprotozoal 4-aryloxy-2-aminoquinolines and related compounds.抗原生动物的4-芳氧基-2-氨基喹啉及相关化合物。
J Med Chem. 1970 Mar;13(2):324-6. doi: 10.1021/jm00296a048.
7
2,4-Diamino-6,7-dimethoxyquinoline derivatives as alpha 1-adrenoceptor antagonists and antihypertensive agents.
J Med Chem. 1988 May;31(5):1031-5. doi: 10.1021/jm00400a025.