Synthesis, Crystal Structure, and Fungicidal Activity of 5-(4-cyclopropyl-5-((3-fluorobenzyl)thio)-4H-1,2,4-triazol-3-yl)-4-methyl-1,2,3-thiadiazole

被引：50

作者：

Liu, Xing-Hai ^{[1
]}

Weng, Jian-Quan ^{[1
]}

Tan, Cheng-Xia ^{[1
]}

机构：

[1] Zhejiang Univ Technol, Coll Chem Engn & Mat Sci, Hangzhou 310014, Zhejiang, Peoples R China

来源：

JOURNAL OF CHEMISTRY | 2013年 / 2013卷

基金：

中国国家自然科学基金;

关键词：

BIOLOGICAL-ACTIVITY; DFT CALCULATION; 1,2,4-TRIAZOLE DERIVATIVES; ANTIFUNGAL ACTIVITY; ANTITUMOR-ACTIVITY; 1,2,3-THIADIAZOLE; BIOACTIVITY;

D O I：

10.1155/2013/306361

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

A new 1,2,3-thiadiazole compound was synthesized and characterized.. e crystal structure of the title compound (C15H14FN5S2, Mr = 347.43) has been determined by single-crystal X-ray diffraction. The crystal is of triclinic, space group P-1 with a = 7.0490(14), b = 9.0212(18), c = 12.799(3) angstrom, alpha = 89.97(3)degrees, beta = 82.27(3)degrees, gamma = 73.17(3)degrees, V = 771.3(3) angstrom(3), Z = 2, F(000) = 360, Dc = 1.496 g/cm(3), mu = 0.036 mm(-1), the final R-1 = 0.0358, and wR(2) = 0.0986 for 2204 observed reflections with I > 2 sigma(I). A total of 5697 reflections were collected, of which 2719 were independent (R-int = 0.0028). e herbicidal activity of title compound was determined; the results showed that the title compound displayed excellent fungicidal activity.

引用

页数：5

共 31 条

[11] Synthesis, crystal structure, bioactivity and DFT calculation of new oxime ester derivatives containing cyclopropane moiety [J].

Liu, Xing-Hai ;

Pan, Li ;

Tan, Cheng-Xia ;

Weng, Jian-Quan ;

Wang, Bao-Lei ;

Li, Zheng-Ming .

PESTICIDE BIOCHEMISTRY AND PHYSIOLOGY, 2011, 101 (03) :143-147

[12] Design, Synthesis, Biological Activities, and 3D-QSAR of New N,N′-Diacylhydrazines Containing 2-(2,4-dichlorophenoxy)propane Moiety [J].

Liu, Xing-Hai ;

Pan, Li ;

Ma, Yi ;

Weng, Jian-Quan ;

Tan, Cheng-Xia ;

Li, Yong-Hong ;

Shi, Yan-Xia ;

Li, Bao-Ju ;

Li, Zheng-Ming ;

Zhang, Yong-Gang .

CHEMICAL BIOLOGY & DRUG DESIGN, 2011, 78 (04) :689-694

[13]

Liu XH, 2011, ASIAN J CHEM, V23, P4064

[14]

Liu XH, 2011, ASIAN J CHEM, V23, P4031

[15] SYNTHESIS, DIMERIC CRYSTAL STRUCTURE, AND FUNGICIDAL ACTIVITY OF 1-(4-METHYLPHENYL)-2-(5-((3,5-DIMETHYL-1H-PYRAZOL-1-YL)METHYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YLTHIO)ETHANONE [J].

Liu, Xing-Hai ;

Tan, Cheng-Xia ;

Weng, Jian-Quan .

PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 2011, 186 (03) :558-564

[16] PHASE TRANSFER-CATALYZED, ONE-POT SYNTHESIS OF SOME NOVEL N-PYRIMIDINYL-N′-NICOTINYL THIOUREA DERIVATIVES [J].

Liu, Xing-Hai ;

Tan, Cheng-Xia ;

Weng, Jian-Quan .

PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 2011, 186 (03) :552-557

[17] 5-(4-Pyridyl)-1,3,4-thiadiazole-2(3H)-thione [J].

Liu, Xu-Feng ;

Liu, Xing-Hai .

ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, 2011, 67 :O202-U3145

[18] NEW CLASS OF PYRETHROIDAL INSECTICIDES ALPHA-SUBSTITUTED PHENYL-ACETIC ACID-ESTERS [J].

OHNO, N ;

FUJIMOTO, K ;

OKUNO, Y ;

MIZUTANI, T ;

HIRANO, M ;

ITAYA, N ;

HONDA, T ;

YOSHIOKA, H .

AGRICULTURAL AND BIOLOGICAL CHEMISTRY, 1974, 38 (04) :881-883

[19] SEARCH FOR NEW DRUGS SYNTHESIS AND ANTITUMOR ACTIVITY OF 3,4,5-SUBSTITUTED 1,2,4-TRIAZOLES [J].

Ovsepyan, T. R. ;

Melik-Ogandzhanyan, R. G. ;

Panosyan, G. A. ;

Arsenyan, F. G. ;

Garibdzhanyan, B. T. .

PHARMACEUTICAL CHEMISTRY JOURNAL, 2009, 43 (12) :645-648

[20]

Sheldrick G. M., 1997, SHELXL 97

← 1 2 3 4 →