Reliable Functionalization of 5,6-Fused Bicyclic N-Heterocycles Pyrazolopyrimidines and Imidazopyridazines via Zinc and Magnesium Organometallics.

DFT calculation N-heterocycle imidazopyridazines magnesium pyrazolopyrimidines

Journal

Chemistry (Weinheim an der Bergstrasse, Germany)
ISSN: 1521-3765
Titre abrégé: Chemistry
Pays: Germany
ID NLM: 9513783

Informations de publication

Date de publication:
10 Jun 2022
Historique:
received: 07 03 2022
pubmed: 7 4 2022
medline: 15 6 2022
entrez: 6 4 2022
Statut: ppublish

Résumé

DFT-calculations allow prediction of the reactivity of uncommon N-heterocyclic scaffolds of pyrazolo[1,5-a]pyrimidines and imidazo[1,2-b]pyridazines and considerably facilitate their functionalization. The derivatization of these N-heterocycles was realized using Grignard reagents for nucleophilic additions to 5-chloropyrazolo[1,5-a]pyrimidines and TMP

Identifiants

pubmed: 35384103
doi: 10.1002/chem.202200733
pmc: PMC9321601
doi:

Substances chimiques

Indicators and Reagents 0
Pyrimidines 0
Magnesium I38ZP9992A
Zinc J41CSQ7QDS

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

e202200733

Subventions

Organisme : Ludwig-Maximilians-Universität München
Organisme : Deutsche Forschungsgemeinschaft

Informations de copyright

© 2022 The Authors. Chemistry - A European Journal published by Wiley-VCH GmbH.

Références

J Med Chem. 2014 Dec 26;57(24):10257-74
pubmed: 25255204
Chemistry. 2009 Jul 20;15(29):7192-202
pubmed: 19544505
Bioorg Med Chem Lett. 2021 Jan 1;31:127712
pubmed: 33246108
Bioorg Chem. 2020 Jun;99:103801
pubmed: 32278206
Drugs. 2019 Feb;79(2):201-206
pubmed: 30635837
Org Lett. 2013 Mar 1;15(5):1128-31
pubmed: 23421375
Chemistry. 2019 Feb 21;25(11):2695-2703
pubmed: 30230067
Org Lett. 2011 Jan 21;13(2):272-5
pubmed: 21138319
Angew Chem Int Ed Engl. 2010 Jul 26;49(32):5451-5
pubmed: 20818766
Angew Chem Int Ed Engl. 2004 Jun 21;43(25):3333-6
pubmed: 15213967
Bioorg Med Chem. 2012 Dec 15;20(24):7051-8
pubmed: 23123015
Angew Chem Int Ed Engl. 2012 Sep 3;51(36):9071-4
pubmed: 22887962
Chem Sci. 2021 Aug 30;12(39):12993-13000
pubmed: 34745530
J Org Chem. 2020 Mar 20;85(6):4096-4102
pubmed: 31995384
Bioorg Med Chem. 2015 Oct 1;23(19):6280-96
pubmed: 26349627
Angew Chem Int Ed Engl. 2006 Apr 28;45(18):2958-61
pubmed: 16568481
Bioorg Med Chem. 2015 Oct 1;23(19):6355-63
pubmed: 26344592
J Am Chem Soc. 2018 Apr 25;140(16):5500-5515
pubmed: 29659264
J Med Chem. 2015 Nov 12;58(21):8713-22
pubmed: 26502160
Angew Chem Int Ed Engl. 2004 Apr 19;43(17):2206-25
pubmed: 15108128
Chemistry. 2013 Jun 10;19(24):7944-60
pubmed: 23584978
J Org Chem. 2013 Oct 18;78(20):10337-43
pubmed: 24059837
Org Lett. 2020 Mar 6;22(5):1899-1902
pubmed: 32048510
Eur J Med Chem. 2020 Dec 15;208:112770
pubmed: 32883634
Chemistry. 2017 Jan 18;23(4):778-782
pubmed: 27862462
Nat Chem. 2019 Dec;11(12):1158-1166
pubmed: 31636393
Angew Chem Int Ed Engl. 2007;46(40):7685-8
pubmed: 17724685
J Am Chem Soc. 2007 Mar 21;129(11):3358-66
pubmed: 17326639
Angew Chem Int Ed Engl. 2011 Jul 18;50(30):6738-64
pubmed: 21717531
J Med Chem. 2014 Nov 13;57(21):8839-48
pubmed: 25313449
Chemistry. 2022 Jun 10;28(33):e202200733
pubmed: 35384103
Molecules. 2020 Apr 20;25(8):
pubmed: 32326131
J Med Chem. 2019 Sep 12;62(17):7923-7940
pubmed: 31381333
Chem Commun (Camb). 2006 Feb 21;(7):726-8
pubmed: 16465320
J Med Chem. 2014 Jul 24;57(14):5845-59
pubmed: 24471928
Chemistry. 2011 Nov 18;17(47):13284-97
pubmed: 22006709
Chem Rev. 2012 May 9;112(5):2642-713
pubmed: 22352938
Angew Chem Int Ed Engl. 2019 Jul 1;58(27):9244-9247
pubmed: 31034125
Eur J Med Chem. 2017 Jan 27;126:298-352
pubmed: 27894044
J Am Chem Soc. 2005 Apr 6;127(13):4685-96
pubmed: 15796535
Angew Chem Int Ed Engl. 2011 Aug 8;50(33):7686-90
pubmed: 21721092
Angew Chem Int Ed Engl. 2020 Aug 24;59(35):14992-14999
pubmed: 32400069
Molecules. 2021 May 05;26(9):
pubmed: 34063043
Org Lett. 2008 Mar 20;10(6):1107-10
pubmed: 18288850
Angew Chem Int Ed Engl. 2013 Jun 24;52(26):6776-80
pubmed: 23703866
J Med Chem. 2009 May 14;52(9):2952-63
pubmed: 19348472
Chempluschem. 2017 May;82(5):750-757
pubmed: 31961519
J Am Chem Soc. 2013 Apr 3;135(13):4958-61
pubmed: 23506449
Expert Rev Clin Pharmacol. 2019 Oct;12(10):931-939
pubmed: 31469968
Angew Chem Int Ed Engl. 2009;48(18):3288-91
pubmed: 19322871

Auteurs

Saroj Kumar Rout (S)

Department Chemie, Ludwig-Maximilians-Universität München, Butenandtstrasse 5-13, Haus F, 81377, München, Germany.

Agonist Kastrati (A)

Department Chemie, Ludwig-Maximilians-Universität München, Butenandtstrasse 5-13, Haus F, 81377, München, Germany.

Harish Jangra (H)

Department Chemie, Ludwig-Maximilians-Universität München, Butenandtstrasse 5-13, Haus F, 81377, München, Germany.

Kuno Schwärzer (K)

Department Chemie, Ludwig-Maximilians-Universität München, Butenandtstrasse 5-13, Haus F, 81377, München, Germany.

Alisa S Sunagatullina (AS)

Department Chemie, Ludwig-Maximilians-Universität München, Butenandtstrasse 5-13, Haus F, 81377, München, Germany.

Maximilien Garny (M)

Department Chemie, Ludwig-Maximilians-Universität München, Butenandtstrasse 5-13, Haus F, 81377, München, Germany.

Fabio Lima (F)

Global Discovery Chemistry, Novartis Institutes for BioMedical Research, 4057, Basel, Switzerland.

Cara E Brocklehurst (CE)

Global Discovery Chemistry, Novartis Institutes for BioMedical Research, 4057, Basel, Switzerland.

Konstantin Karaghiosoff (K)

Department Chemie, Ludwig-Maximilians-Universität München, Butenandtstrasse 5-13, Haus F, 81377, München, Germany.

Hendrik Zipse (H)

Department Chemie, Ludwig-Maximilians-Universität München, Butenandtstrasse 5-13, Haus F, 81377, München, Germany.

Paul Knochel (P)

Department Chemie, Ludwig-Maximilians-Universität München, Butenandtstrasse 5-13, Haus F, 81377, München, Germany.

Articles similaires

Psoriasis Humans Magnesium Zinc Trace Elements
Tumor Microenvironment Nanoparticles Immunotherapy Cellular Senescence Animals
Testicular Neoplasms Neoplasms, Germ Cell and Embryonal Humans Cisplatin Jumonji Domain-Containing Histone Demethylases
Animals Macrophages Mice Cation Transport Proteins Salmonella typhimurium

Classifications MeSH