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IMD-0560

CAT: 1410-M24398-07Size: 200 mgDry Ice: NoHazardous: No
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CAT#:1410-M24398-07Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
IMD-0560 is a novel inhibitor of IκB kinase β.
CAS Number
439144-66-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
428.12
Molecular Formula
C15H8BrF6NO2
Notes
Research use only, not for human use.
Receptor
IKKβ

Chemical Information

Imd-0560
CAS Number439144-66-8
PubChem CID11464503
IUPAC NameN-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide
Molecular FormulaC15H8BrF6NO2
Molecular Weight428.12
XLogP5.4
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Heavy Atom Count25
Formal Charge0
Complexity484
SMILES
C1=CC(=C(C=C1C(F)(F)F)NC(=O)C2=C(C=CC(=C2)Br)O)C(F)(F)F
InChI
InChI=1S/C15H8BrF6NO2/c16-8-2-4-12(24)9(6-8)13(25)23-11-5-7(14(17,18)19)1-3-10(11)15(20,21)22/h1-6,24H,(H,23,25)
InChIKey
SVGRIJCSKWXOPA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Imd-0560
CAS: 439144-66-8
CID: 11464503
Formula: C15H8BrF6NO2
MW: 428.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight428.12
XLogP35.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Exact Mass426.96426
Monoisotopic Mass426.96426
Topological Polar Surface Area49.3 Ų
Heavy Atom Count25
Formal Charge0
Complexity484
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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A19224-100IMD-0560 100mg
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