RA-839

CAT: 0013-GTR19196655-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19196655-02Size:10 mg

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Description

RA-839 is a selective small molecule activator of Nrf2 signaling that functions by covalently binding to Keap1 and disrupting the Keap1-Nrf2 interaction. It demonstrates anticancer activity and has been shown in research to suppress inducible nitric oxide synthase expression and nitric oxide production in both cellular and animal models of oxidative stress and inflammation.

CAS Number

1832713-02-6

Product Name Alternative

RA 839, RA839, RA-839, KEAP1-Nrf2

Field of Research

Immunology & Inflammation

Purity

98.38% (May vary between batches)

Solubility

DMSO:80 mg/mL (176.77 mM)

Smiles

Cc1cc (C) c (C) c (c1C) S (=O) (=O) Nc1ccc (N2CC[C@@H] (C2) C (O) =O) c2ccccc12

Molecular Formula

C25H28N2O4S

Molecular Weight

452.57

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

(3s)-1-(4-{[(2,3,5,6-Tetramethylphenyl)sulfonyl]amino}naphthalen-1-Yl)pyrrolidine-3-Carboxylic Acid

CAS Number	1832713-02-6
PubChem CID	91971266
IUPAC Name	(3S)-1-[4-[(2,3,5,6-tetramethylphenyl)sulfonylamino]naphthalen-1-yl]pyrrolidine-3-carboxylic acid
Molecular Formula	C25H28N2O4S
Molecular Weight	452.6
XLogP	4.9
Topological Polar Surface Area	95.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Heavy Atom Count	32
Formal Charge	0
Complexity	767

SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)NC2=CC=C(C3=CC=CC=C32)N4CC[C@@H](C4)C(=O)O)C)C

InChI

InChI=1S/C25H28N2O4S/c1-15-13-16(2)18(4)24(17(15)3)32(30,31)26-22-9-10-23(21-8-6-5-7-20(21)22)27-12-11-19(14-27)25(28)29/h5-10,13,19,26H,11-12,14H2,1-4H3,(H,28,29)/t19-/m0/s1

InChIKey

BVYWIQHJXAEJOD-IBGZPJMESA-N

Chemical Structure

2D Structure

CAS: 1832713-02-6

CID: 91971266

Formula: C25H28N2O4S

MW: 452.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	452.6
XLogP3	4.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Exact Mass	452.17697855
Monoisotopic Mass	452.17697855
Topological Polar Surface Area	95.1 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	767
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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GTR19276234-01	CRBN ligand-839
GTR19249242-01	RA-PR058
GTR19242373-01	RA-0002034
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561359	RA-839
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5707/10	RA 839 10 mg
R729035	RA 839 (May contain up to 10% inorganics)
B1179-5	CB-839
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FC103571-01	CB 839
HY-117955	GMA-839

RA-839

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