CHEBI:77774 - SCH-351591

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ChEBI Name SCH-351591
ChEBI ID CHEBI:77774
Definition An 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).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C17H10Cl2F3N3O3
Net Charge 0
Average Mass 432.18100
Monoisotopic Mass 431.00513
InChI InChI=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)
InChIKey RUOGJYKOQBFJIG-UHFFFAOYSA-N
SMILES COc1ccc(C(=O)Nc2c(Cl)c[n+]([O-])cc2Cl)c2ccc(nc12)C(F)(F)F
Roles Classification
Biological Role(s): phosphodiesterase IV inhibitor
An EC 3.1.4.53 (3',5'-cyclic-AMP phosphodiesterase) inhibitor that specifically blocks the action of phosphodiesterase IV.
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ChEBI Ontology
Outgoing 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 Sources
8-methoxy-2-trifluoromethylquinoline-5-carboxylic acid (3,5-dichloro-1-oxypyridin-4-yl)amide ChEBI
N-(3,5-dichloro-1-oxido-4-pyridinyl)-8-methoxy-2-(trifluoromethyl)-5-quinoline carboxamide ChemIDplus
Sch 351591 ChemIDplus
Sch-351591 ChemIDplus
SCH351591 ChEBI
Manual Xref Database
NZ528621 Patent
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Registry Numbers Types Sources
444659-43-2 CAS Registry Number ChemIDplus
9159062 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
12039576 PubMed citation Europe PMC
12065709 PubMed citation Europe PMC
15204971 PubMed citation Europe PMC
15498513 PubMed citation Europe PMC
18776163 PubMed citation Europe PMC
18776166 PubMed citation Europe PMC
20460440 PubMed citation Europe PMC
20585143 PubMed citation Europe PMC
Last Modified
19 March 2014