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CA-4948

CAT: 1410-M12741-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:1410-M12741-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
CA-4948 (AU-4948) is a novel potent, selective, orally bioavailable IRAK4 inhibitor.
CAS Number
1801343-74-7
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
417.429
Molecular Formula
C21H19N7O3
Notes
Research use only, not for human use.
Receptor
IRAK

Chemical Information

CA-4948
CAS Number1801343-74-7
PubChem CID118224238
IUPAC Name6-(6-amino-3-pyridinyl)-N-(2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl)pyridine-2-carboxamide
Molecular FormulaC21H19N7O3
Molecular Weight417.4
XLogP1.5
Topological Polar Surface Area132
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Heavy Atom Count31
Formal Charge0
Complexity620
SMILES
C1COCCN1C2=NC3=C(O2)C=C(C=N3)NC(=O)C4=CC=CC(=N4)C5=CN=C(C=C5)N
InChI
InChI=1S/C21H19N7O3/c22-18-5-4-13(11-23-18)15-2-1-3-16(26-15)20(29)25-14-10-17-19(24-12-14)27-21(31-17)28-6-8-30-9-7-28/h1-5,10-12H,6-9H2,(H2,22,23)(H,25,29)
InChIKey
RWIMETUXCNDSLE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of CA-4948
CAS: 1801343-74-7
CID: 118224238
Formula: C21H19N7O3
MW: 417.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight417.4
XLogP31.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Exact Mass417.15493749
Monoisotopic Mass417.15493749
Topological Polar Surface Area132 Ų
Heavy Atom Count31
Formal Charge0
Complexity620
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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T9027-01CA-4948
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A17005-5CA-4948 5mg
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A17005-10CA-4948 10mg
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A17005-100CA-4948 100mg
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A17005-10mM-DCA-4948 10mM * 1mL in DMSO

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