6-bromo-n-(3-(difluoromethyl)phenyl)quinolin-4-amine
6-bromo-n-(3-(difluoromethyl)phenyl)quinolin-4-amine
A routine synthesis was performed to furnish the title compound which incorporates a versatile difluoromethyl group on the aniline substitution of a 4-anilinoquinoline kinase inhibitor motif. In addition, the small molecule crystal structure (of the HCL salt) was solved, which uncovered that the difluoromethyl group was disordered within the packing arrangement and also a 126.08(7)_out of plane character between the respective ring systems within the molecule. The compound was fully characterized with 1H/13C-NMR and high-resolution mass spectra (HRMS), with the procedures described.
4-anilino-quin(az)olines, Conformational flexibility, Hinge binder, Kinase inhibitor design
1-7
Asquith, Christopher R.M.
51f24044-1f40-43c7-806a-2e78fdcc2733
Tizzard, Graham J.
8474c0fa-40df-43a6-a662-7f3c4722dbf2
Asquith, Christopher R.M.
51f24044-1f40-43c7-806a-2e78fdcc2733
Tizzard, Graham J.
8474c0fa-40df-43a6-a662-7f3c4722dbf2
Asquith, Christopher R.M. and Tizzard, Graham J.
(2020)
6-bromo-n-(3-(difluoromethyl)phenyl)quinolin-4-amine.
Molbank, 2020 (4), , [M1161].
(doi:10.3390/M1161).
Abstract
A routine synthesis was performed to furnish the title compound which incorporates a versatile difluoromethyl group on the aniline substitution of a 4-anilinoquinoline kinase inhibitor motif. In addition, the small molecule crystal structure (of the HCL salt) was solved, which uncovered that the difluoromethyl group was disordered within the packing arrangement and also a 126.08(7)_out of plane character between the respective ring systems within the molecule. The compound was fully characterized with 1H/13C-NMR and high-resolution mass spectra (HRMS), with the procedures described.
Text
molbank-2020-M1161-v4 (1)
- Version of Record
More information
Accepted/In Press date: 15 October 2020
e-pub ahead of print date: 20 October 2020
Keywords:
4-anilino-quin(az)olines, Conformational flexibility, Hinge binder, Kinase inhibitor design
Identifiers
Local EPrints ID: 445111
URI: http://eprints.soton.ac.uk/id/eprint/445111
ISSN: 1422-8599
PURE UUID: 44a437a3-3a55-4444-ac09-e25558c7ec08
Catalogue record
Date deposited: 19 Nov 2020 17:32
Last modified: 18 Mar 2024 02:54
Export record
Altmetrics
Contributors
Author:
Christopher R.M. Asquith
Download statistics
Downloads from ePrints over the past year. Other digital versions may also be available to download e.g. from the publisher's website.
View more statistics
