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BAY 678 - ≥98%(HPLC), high purity , CAS No.675103-36-3
Potent and selective cell-permeable human neutrophil elastase (HNE) inhibitor
Basic Description Synonyms BAY-678 | 675103-36-3 | BAY678 | WD9FU5A8DR | BAY 678 | UNII-WD9FU5A8DR | 5-[(6r)-5-Ethanoyl-4-Methyl-2-Oxidanylidene-3-[3-(Trifluoromethyl)phenyl]-1,6-Dihydropyrimidin-6-Yl]pyridine-2-Carbonitrile | CHEMBL3617968 | 2-Pyridinecarbonitrile, 5-((4R)-5-acetyl-1,2,3,4-tetrah Specifications & Purity ≥98%(HPLC) Biochemical and Physiological Mechanisms Potent and selective cell-permeable human neutrophil elastase (HNE) inhibitor (IC50= 20 nM). Exhibits around 2000-fold selectivity for NHE against a panel of 21 other serine proteases. Effective in an acute lung injury modelin vivo. Orally bioavailable. I Storage Temp Store at -20°C Shipped In Ice chest + Ice pads
Associated Targets(Human) Associated Targets(non-human) Names and Identifiers IUPAC Name 5-[(6R)-5-acetyl-4-methyl-2-oxo-3-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidin-6-yl]pyridine-2-carbonitrile INCHI InChI=1S/C20H15F3N4O2/c1-11-17(12(2)28)18(13-6-7-15(9-24)25-10-13)26-19(29)27(11)16-5-3-4-14(8-16)20(21,22)23/h3-8,10,18H,1-2H3,(H,26,29)/t18-/m1/s1 InChi Key PGIVGIFOWOVINL-GOSISDBHSA-N Canonical SMILES CC1=C(C(NC(=O)N1C2=CC=CC(=C2)C(F)(F)F)C3=CN=C(C=C3)C#N)C(=O)C Isomeric SMILES CC1=C([C@H](NC(=O)N1C2=CC=CC(=C2)C(F)(F)F)C3=CN=C(C=C3)C#N)C(=O)C PubChem CID 23728722 Molecular Weight 400.35
Chemical and Physical Properties Solubility Solvent:DMSO, Max Conc. mg/mL: 40.03, Max Conc. mM: 100
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