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Site-specific template generative approach for retrosynthetic planning.

Autor: Shee Y; Department of Chemistry, Yale University, New Haven, CT, USA., Li H; Department of Chemistry, Yale University, New Haven, CT, USA., Zhang P; Department of Chemistry, Yale University, New Haven, CT, USA., Nikolic AM; Department of Chemistry, Yale University, New Haven, CT, USA., Lu W; Department of Chemistry, Yale University, New Haven, CT, USA., Kelly HR; Chemical Development, Boehringer Ingelheim Pharmaceuticals Inc, Ridgefield, CT, USA., Manee V; Chemical Development, Boehringer Ingelheim Pharmaceuticals Inc, Ridgefield, CT, USA., Sreekumar S; Chemical Development, Boehringer Ingelheim Pharmaceuticals Inc, Ridgefield, CT, USA., Buono FG; Chemical Development, Boehringer Ingelheim Pharmaceuticals Inc, Ridgefield, CT, USA., Song JJ; Chemical Development, Boehringer Ingelheim Pharmaceuticals Inc, Ridgefield, CT, USA., Newhouse TR; Department of Chemistry, Yale University, New Haven, CT, USA. timothy.newhouse@yale.edu., Batista VS; Department of Chemistry, Yale University, New Haven, CT, USA. victor.batista@yale.edu.

Publikováno v: Nature communications [Nat Commun] 2024 Sep 06; Vol. 15 (1), pp. 7818. Date of Electronic Publication: 2024 Sep 06.

Autonomous Multi-Step and Multi-Objective Optimization Facilitated by Real-Time Process Analytics.

Autor: Sagmeister P; Institute of Chemistry, University of Graz, NAWI Graz, Heinrichstrasse 28, Graz, 8010, Austria.; Center for Continuous Flow Synthesis and Processing (CCFLOW), Research Center Pharmaceutical Engineering GmbH (RCPE), Inffeldgasse 13, Graz, 8010, Austria., Ort FF; Institute of Chemistry, University of Graz, NAWI Graz, Heinrichstrasse 28, Graz, 8010, Austria., Jusner CE; Institute of Chemistry, University of Graz, NAWI Graz, Heinrichstrasse 28, Graz, 8010, Austria.; Center for Continuous Flow Synthesis and Processing (CCFLOW), Research Center Pharmaceutical Engineering GmbH (RCPE), Inffeldgasse 13, Graz, 8010, Austria., Hebrault D; Chemical Development US, Boehringer Ingelheim Pharmaceuticals, Inc., 900 Ridgebury Road, Ridgefield, Connecticut, 06877, USA., Tampone T; Chemical Development US, Boehringer Ingelheim Pharmaceuticals, Inc., 900 Ridgebury Road, Ridgefield, Connecticut, 06877, USA., Buono FG; Chemical Development US, Boehringer Ingelheim Pharmaceuticals, Inc., 900 Ridgebury Road, Ridgefield, Connecticut, 06877, USA., Williams JD; Institute of Chemistry, University of Graz, NAWI Graz, Heinrichstrasse 28, Graz, 8010, Austria.; Center for Continuous Flow Synthesis and Processing (CCFLOW), Research Center Pharmaceutical Engineering GmbH (RCPE), Inffeldgasse 13, Graz, 8010, Austria., Kappe CO; Institute of Chemistry, University of Graz, NAWI Graz, Heinrichstrasse 28, Graz, 8010, Austria.; Center for Continuous Flow Synthesis and Processing (CCFLOW), Research Center Pharmaceutical Engineering GmbH (RCPE), Inffeldgasse 13, Graz, 8010, Austria.

Publikováno v: Advanced science (Weinheim, Baden-Wurttemberg, Germany) [Adv Sci (Weinh)] 2022 Apr; Vol. 9 (10), pp. e2105547. Date of Electronic Publication: 2022 Feb 01.

Sequential C-H Arylation and Enantioselective Hydrogenation Enables Ideal Asymmetric Entry to the Indenopiperidine Core of an 11β-HSD-1 Inhibitor.

Autor: Wei X; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Qu B; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Zeng X; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Savoie J; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Fandrick KR; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Desrosiers JN; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Tcyrulnikov S; Department of Chemistry, University of Pennsylvania , Philadelphia, Pennsylvania 19104, United States., Marsini MA; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Buono FG; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Li Z; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Yang BS; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Tang W; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Haddad N; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Gutierrez O; Department of Chemistry, University of Pennsylvania , Philadelphia, Pennsylvania 19104, United States., Wang J; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Lee H; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Ma S; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Campbell S; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Lorenz JC; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Eckhardt M; Medicinal Chemistry, Boehringer Ingelheim Pharma GmbH & Co. KG , Birkendorfer Strasse 65, 88397 Biberach/Riss, Germany., Himmelsbach F; Medicinal Chemistry, Boehringer Ingelheim Pharma GmbH & Co. KG , Birkendorfer Strasse 65, 88397 Biberach/Riss, Germany., Peters S; Medicinal Chemistry, Boehringer Ingelheim Pharma GmbH & Co. KG , Birkendorfer Strasse 65, 88397 Biberach/Riss, Germany., Patel ND; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Tan Z; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Yee NK; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Song JJ; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Roschangar F; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States., Kozlowski MC; Department of Chemistry, University of Pennsylvania , Philadelphia, Pennsylvania 19104, United States., Senanayake CH; Chemical Development, Boehringer Ingelheim Pharmaceuticals, Inc. , 900 Ridgebury Road, Ridgefield, Connecticut 06877, United States.

Publikováno v: Journal of the American Chemical Society [J Am Chem Soc] 2016 Nov 30; Vol. 138 (47), pp. 15473-15481. Date of Electronic Publication: 2016 Nov 17.

Development of an asymmetric synthesis of a chiral quaternary FLAP inhibitor.

Autor: Fandrick KR; Department of Chemical Development, Boehringer-Ingelheim Pharmaceuticals Inc. , 900 Ridgebury Road, P.O. Box 368, Ridgefield, Connecticut 06877-0368, United States., Mulder JA, Patel ND, Gao J, Konrad M, Archer E, Buono FG, Duran A, Schmid R, Daeubler J, Desrosiers JN, Zeng X, Rodriguez S, Ma S, Qu B, Li Z, Fandrick DR, Grinberg N, Lee H, Bosanac T, Takahashi H, Chen Z, Bartolozzi A, Nemoto P, Busacca CA, Song JJ, Yee NK, Mahaney PE, Senanayake CH

Publikováno v: The Journal of organic chemistry [J Org Chem] 2015 Feb 06; Vol. 80 (3), pp. 1651-60. Date of Electronic Publication: 2015 Jan 22.