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SCH-351591

CAT: 0013-GTR19199664-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19199664-01Size:25 mg
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Description
SCH-351591 is a potent and selective phosphodiesterase 4 (PDE4) inhibitor suitable for oral administration in research settings. It is utilized in preclinical studies to investigate PDE4's role in inflammatory and neurological processes, with applications in both in vitro assays and in vivo animal models.
CAS Number
444659-43-2
Field of Research
Metabolism Research, Signal Transduction
Smiles
C (NC=1C (Cl) =CN (=O) =CC1Cl) (=O) C=2C3=C (C (OC) =CC2) N=C (C (F) (F) F) C=C3
Molecular Formula
C17H10Cl2F3N3O3
Molecular Weight
432.18
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(3,5-Dichloro-1-oxido-4-pyridinyl)-8-methoxy-2-(trifluoromethyl)-5-quinoline carboxamide

SCH-351591 is 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). It has a role as a phosphodiesterase IV inhibitor. It is a member of quinolines, a monocarboxylic acid amide, an aromatic ether, an organofluorine compound, a member of pyridine N-oxides, a chloropyridine and an aromatic amide.

CAS Number444659-43-2
PubChem CID9802841
IUPAC NameN-(3,5-dichloro-1-hydroxy-4-pyridinylidene)-8-methoxy-2-(trifluoromethyl)quinoline-5-carboxamide
Molecular FormulaC17H10Cl2F3N3O3
Molecular Weight432.2
XLogP4.3
Topological Polar Surface Area75
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Heavy Atom Count28
Formal Charge0
Complexity704
SMILES
COC1=C2C(=C(C=C1)C(=O)N=C3C(=CN(C=C3Cl)O)Cl)C=CC(=N2)C(F)(F)F
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/h2-7,27H,1H3
InChIKey
NPGREARFJMFTDF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(3,5-Dichloro-1-oxido-4-pyridinyl)-8-methoxy-2-(trifluoromethyl)-5-quinoline carboxamide
CAS: 444659-43-2
CID: 9802841
Formula: C17H10Cl2F3N3O3
MW: 432.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight432.2
XLogP34.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Exact Mass431.0051311
Monoisotopic Mass431.0051311
Topological Polar Surface Area75 Ų
Heavy Atom Count28
Formal Charge0
Complexity704
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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