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MSU-42011

CAT: 0013-GTR19211967-03Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211967-03Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
MSU-42011 is a potent, orally bioavailable RXR agonist that suppresses iNOS, SREBP, and p-ERK protein expression. It exhibits immunomodulatory and antitumor efficacy in preclinical models, including in vivo studies of KRAS-driven lung cancer, highlighting its utility in oncology and immunology research.
CAS Number
2456434-36-7
Product Name Alternative
6 ((3,5ditertbutylphenyl) (isobutyl) amino) nicotinicacid, Inos, MSU 42011, MSU42011, MSU-42011, NOSynthase, NO Synthase, Retinoid Receptor, RetinoidReceptor, SREBP, RXR, PERK
Field of Research
Immunology & Inflammation, Metabolism Research, Signal Transduction
Purity
99.04% (May vary between batches)
Solubility
DMSO:45 mg/mL (117.63 mM)
Smiles
N (CC (C) C) (C1=CC (C (C) (C) C) =CC (C (C) (C) C) =C1) C2=CC=C (C (O) =O) C=N2
Molecular Formula
C24H34N2O2
Molecular Weight
382.54
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

6-((3,5-Di-tert-butylphenyl)(isobutyl)amino)nicotinic acid
CAS Number2456434-36-7
PubChem CID154656181
IUPAC Name6-[3,5-ditert-butyl-N-(2-methylpropyl)anilino]pyridine-3-carboxylic acid
Molecular FormulaC24H34N2O2
Molecular Weight382.5
XLogP7.1
Topological Polar Surface Area53.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity496
SMILES
CC(C)CN(C1=NC=C(C=C1)C(=O)O)C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C
InChI
InChI=1S/C24H34N2O2/c1-16(2)15-26(21-10-9-17(14-25-21)22(27)28)20-12-18(23(3,4)5)11-19(13-20)24(6,7)8/h9-14,16H,15H2,1-8H3,(H,27,28)
InChIKey
VCRGDWUAXDMPKH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-((3,5-Di-tert-butylphenyl)(isobutyl)amino)nicotinic acid
CAS: 2456434-36-7
CID: 154656181
Formula: C24H34N2O2
MW: 382.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.5
XLogP37.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass382.262028332
Monoisotopic Mass382.262028332
Topological Polar Surface Area53.4 Ų
Heavy Atom Count28
Formal Charge0
Complexity496
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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