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CHEBI:77774 - SCH-351591

ChEBI IDCHEBI:77774
ChEBI NameSCH-351591
Stars
DefinitionAn aromatic amide resulting from the formal condensation of the carboxy group of 8-methoxy-2-(trifluoromethyl)quinoline-5-carboxylic acid with the primary amino group of 3,5-dichloropyridin-4-amine 1-oxide. It is a potent inhibitor of phosphodiesterase IV (PDE4).
Last Modified19 March 2014
SubmitterGareth Owen
DownloadsMolfile
FormulaC17H10Cl2F3N3O3
Net Charge0
Average Mass432.185
Monoisotopic Mass431.00513
SMILESCOc1ccc(C(=O)Nc2c(Cl)c[n+]([O-])cc2Cl)c2ccc(C(F)(F)F)nc12
InChIInChI=1S/C17H10Cl2F3N3O3/c1-28-12-4-2-9(8-3-5-13(17(20,21)22)23-14(8)12)16(26)24-15-10(18)6-25(27)7-11(15)19/h2-7H,1H3,(H,24,26)
InChIKeyRUOGJYKOQBFJIG-UHFFFAOYSA-N
Roles Classification
Biological Role:
phosphodiesterase IV inhibitor  An EC 3.1.4.53 (3',5'-cyclic-AMP phosphodiesterase) inhibitor that specifically blocks the action of phosphodiesterase IV.
ChEBI Ontology
Outgoing Relation(s)
SCH-351591 (CHEBI:77774) has role phosphodiesterase IV inhibitor (CHEBI:68844)
SCH-351591 (CHEBI:77774) is a aromatic amide (CHEBI:62733)
SCH-351591 (CHEBI:77774) is a aromatic ether (CHEBI:35618)
SCH-351591 (CHEBI:77774) is a chloropyridine (CHEBI:39173)
SCH-351591 (CHEBI:77774) is a monocarboxylic acid amide (CHEBI:29347)
SCH-351591 (CHEBI:77774) is a organofluorine compound (CHEBI:37143)
SCH-351591 (CHEBI:77774) is a pyridine N-oxides (CHEBI:38189)
SCH-351591 (CHEBI:77774) is a quinolines (CHEBI:26513)
IUPAC Name 
N-(3,5-dichloro-1-oxidopyridin-4-yl)-8-methoxy-2-(trifluoromethyl)quinoline-5-carboxamide
Synonyms  Source
Sch-351591ChemIDplus
SCH351591ChEBI
Sch 351591ChemIDplus
N-(3,5-dichloro-1-oxido-4-pyridinyl)-8-methoxy-2-(trifluoromethyl)-5-quinoline carboxamideChemIDplus
8-methoxy-2-trifluoromethylquinoline-5-carboxylic acid (3,5-dichloro-1-oxypyridin-4-yl)amideChEBI
Manual XrefsDatabases
NZ528621Patent
Registry NumbersSources
Reaxys:9159062Reaxys
CAS:444659-43-2ChemIDplus
Citations