KYA1797K

CAT: 0957-S8327-02Size: 10 mm/ 1 mLDry Ice: YesHazardous: No

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CAT#:0957-S8327-02Size:10 mm/ 1 mL

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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Description

KYA1797K is a highly potent and selective Wnt/β-catenin inhibitor with IC50 of 0.75 μM (TOPflash assay) .

CAS Number

1956356-56-1

Target

Wnt/beta-catenin

Activity

Cytoskeletal Signaling

Molecular Formula

C17H11N2O6S2.K

Storage Conditions

2 years -80 in solvent

Chemical Information

(5Z)-5-((5-(4-Nitrophenyl)-2-furanyl)methylene)-4-oxo-2-thioxo-3-thiazolidinepropanoic acid potassium salt

CAS Number	1956356-56-1
PubChem CID	119057297
IUPAC Name	potassium 3-[(5Z)-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate
Molecular Formula	C17H11KN2O6S2
Molecular Weight	442.5
Topological Polar Surface Area	177
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	4
Heavy Atom Count	28
Formal Charge	0
Complexity	663

SMILES

C1=CC(=CC=C1C2=CC=C(O2)/C=C\3/C(=O)N(C(=S)S3)CCC(=O)[O-])[N+](=O)[O-].[K+]

InChI

InChI=1S/C17H12N2O6S2.K/c20-15(21)7-8-18-16(22)14(27-17(18)26)9-12-5-6-13(25-12)10-1-3-11(4-2-10)19(23)24;/h1-6,9H,7-8H2,(H,20,21);/q;+1/p-1/b14-9-;

InChIKey

PHUNRLYHXGMOLG-WQRRWHLMSA-M

Chemical Structure

2D Structure

CAS: 1956356-56-1

CID: 119057297

Formula: C17H11KN2O6S2

MW: 442.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	442.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	4
Exact Mass	441.96955991
Monoisotopic Mass	441.96955991
Topological Polar Surface Area	177 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	663
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes