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MSU-42011

CAT: 0957-E1468-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0957-E1468-02Size:25 mg
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Description
MSU-42011 is an orally active agonist of retinoid X receptor (RXR) . MSU-42011 inhibits the expression of iNOS and p-ERK protein. It exhibits immunomodulatory and antitumor activity. MSU-42011 can be used for cancer research.
CAS Number
2456434-36-7
Target
Retinoid Receptor
Activity
Metabolism
Molecular Formula
C24H34N2O2

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
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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

Alternative Products

CatalogName
HY-153832-01MSU-42011
GTR19272841-01MSU-44147
GTR19234948-01MSU-43085
GTR19272851-01MSU-43557
tlrl-msuMSU Crystals
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bs-75638CMonosodium urate [MSU] (crystals)
045039-01Monosodium Urate (MSU), ready-to-use liquid
U2015-06Y-01Uric Acid Sodium Salt (Monosodium Urate, MSU)
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