6-Bromo-<i>N</i>-(2-methyl-2<i>H</i>-benzo[<i>d</i>][1,2,3]triazol-5-yl)quinolin-4-amine

We describe a straightforward synthesis of the title compound, incorporating a relatively rare 2-methyl-2<i>H</i>-1,2,3-triazole heterocylic motif as a potential kinase inhibitor motif. The small molecule crystal structure has been resolved, revealing an interesting packing arrangement a...

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Main Authors: Christopher R. M. Asquith, Graham J. Tizzard
Format: Article
Language:English
Published: MDPI AG 2019-10-01
Series:Molbank
Subjects:
Online Access:https://www.mdpi.com/1422-8599/2019/4/M1087
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author Christopher R. M. Asquith
Graham J. Tizzard
author_facet Christopher R. M. Asquith
Graham J. Tizzard
author_sort Christopher R. M. Asquith
collection DOAJ
description We describe a straightforward synthesis of the title compound, incorporating a relatively rare 2-methyl-2<i>H</i>-1,2,3-triazole heterocylic motif as a potential kinase inhibitor motif. The small molecule crystal structure has been resolved, revealing an interesting packing arrangement and overall conformation. We also performed routine characterization with <sup>1</sup>H/<sup>13</sup>C-NMR and liquid chromatography (LC) and high-resolution mass spectra (HRMS).
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spelling doaj.art-90388ed5c4e043eb93aacdd15df54d392022-12-21T18:34:28ZengMDPI AGMolbank1422-85992019-10-0120194M108710.3390/M1087M10876-Bromo-<i>N</i>-(2-methyl-2<i>H</i>-benzo[<i>d</i>][1,2,3]triazol-5-yl)quinolin-4-amineChristopher R. M. Asquith0Graham J. Tizzard1Department of Pharmacology, School of Medicine, University of North Carolina at Chapel Hill, Chapel Hill, NC 27599, USAUK National Crystallography Service, School of Chemistry, University of Southampton, Highfield Campus, Southampton SO17 1BJ, UKWe describe a straightforward synthesis of the title compound, incorporating a relatively rare 2-methyl-2<i>H</i>-1,2,3-triazole heterocylic motif as a potential kinase inhibitor motif. The small molecule crystal structure has been resolved, revealing an interesting packing arrangement and overall conformation. We also performed routine characterization with <sup>1</sup>H/<sup>13</sup>C-NMR and liquid chromatography (LC) and high-resolution mass spectra (HRMS).https://www.mdpi.com/1422-8599/2019/4/M10872-methyl-2<i>h</i>-1,2,3-triazole4-anilino-quin(az)olinesconformational flexibilityhinge binderkinase inhibitor design
spellingShingle Christopher R. M. Asquith
Graham J. Tizzard
6-Bromo-<i>N</i>-(2-methyl-2<i>H</i>-benzo[<i>d</i>][1,2,3]triazol-5-yl)quinolin-4-amine
Molbank
2-methyl-2<i>h</i>-1,2,3-triazole
4-anilino-quin(az)olines
conformational flexibility
hinge binder
kinase inhibitor design
title 6-Bromo-<i>N</i>-(2-methyl-2<i>H</i>-benzo[<i>d</i>][1,2,3]triazol-5-yl)quinolin-4-amine
title_full 6-Bromo-<i>N</i>-(2-methyl-2<i>H</i>-benzo[<i>d</i>][1,2,3]triazol-5-yl)quinolin-4-amine
title_fullStr 6-Bromo-<i>N</i>-(2-methyl-2<i>H</i>-benzo[<i>d</i>][1,2,3]triazol-5-yl)quinolin-4-amine
title_full_unstemmed 6-Bromo-<i>N</i>-(2-methyl-2<i>H</i>-benzo[<i>d</i>][1,2,3]triazol-5-yl)quinolin-4-amine
title_short 6-Bromo-<i>N</i>-(2-methyl-2<i>H</i>-benzo[<i>d</i>][1,2,3]triazol-5-yl)quinolin-4-amine
title_sort 6 bromo i n i 2 methyl 2 i h i benzo i d i 1 2 3 triazol 5 yl quinolin 4 amine
topic 2-methyl-2<i>h</i>-1,2,3-triazole
4-anilino-quin(az)olines
conformational flexibility
hinge binder
kinase inhibitor design
url https://www.mdpi.com/1422-8599/2019/4/M1087
work_keys_str_mv AT christopherrmasquith 6bromoini2methyl2ihibenzoidi123triazol5ylquinolin4amine
AT grahamjtizzard 6bromoini2methyl2ihibenzoidi123triazol5ylquinolin4amine