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SU-909

CAT: 1410-M13383Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1410-M13383Size:1 Each
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SU-909 (SU909, IKKα-IN-48) is a potent, selective IKKα inhibitor with Ki of 0.08±0.07 uM.
CAS Number
2126749-48-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
314.323
Molecular Formula
C13H10N6O2S
Notes
Research use only, not for human use.
Receptor
IκB kinase (IKK)

Chemical Information

4-{2-amino-5-cyano-7H-pyrrolo[2,3-d]pyrimidin-4-yl}benzene-1-sulfonamide
CAS Number2126749-48-0
PubChem CID137641677
IUPAC Name4-(2-amino-5-cyano-7H-pyrrolo[2,3-d]pyrimidin-4-yl)benzenesulfonamide
Molecular FormulaC13H10N6O2S
Molecular Weight314.32
XLogP0.3
Topological Polar Surface Area160
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity559
SMILES
C1=CC(=CC=C1C2=C3C(=CNC3=NC(=N2)N)C#N)S(=O)(=O)N
InChI
InChI=1S/C13H10N6O2S/c14-5-8-6-17-12-10(8)11(18-13(15)19-12)7-1-3-9(4-2-7)22(16,20)21/h1-4,6H,(H2,16,20,21)(H3,15,17,18,19)
InChIKey
MPTGZYHKBIOUAJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-{2-amino-5-cyano-7H-pyrrolo[2,3-d]pyrimidin-4-yl}benzene-1-sulfonamide
CAS: 2126749-48-0
CID: 137641677
Formula: C13H10N6O2S
MW: 314.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight314.32
XLogP30.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Exact Mass314.05859476
Monoisotopic Mass314.05859476
Topological Polar Surface Area160 Ų
Heavy Atom Count22
Formal Charge0
Complexity559
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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