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IWP-4

CAT: 0957-E0033-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0957-E0033-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
IWP-4 is a potent Wnt/β-catenin signaling pathway inhibitor with an IC50 of 25 nM.
CAS Number
686772-17-8
Target
Wnt/beta-catenin
Activity
Cytoskeletal Signaling
Molecular Formula
C23H20N4O3S3
Storage Conditions
3 years -20°C powder

Chemical Information

2-((3-(2-methoxyphenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)-N-(6-methylbenzo[d]thiazol-2-yl)acetamide
CAS Number686772-17-8
PubChem CID2155264
IUPAC Name2-[[3-(2-methoxyphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Molecular FormulaC23H20N4O3S3
Molecular Weight496.6
XLogP4.8
Topological Polar Surface Area163
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity851
SMILES
CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC4=C(C(=O)N3C5=CC=CC=C5OC)SCC4
InChI
InChI=1S/C23H20N4O3S3/c1-13-7-8-14-18(11-13)33-22(24-14)26-19(28)12-32-23-25-15-9-10-31-20(15)21(29)27(23)16-5-3-4-6-17(16)30-2/h3-8,11H,9-10,12H2,1-2H3,(H,24,26,28)
InChIKey
RHUJMHOIQBDFQR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-((3-(2-methoxyphenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)-N-(6-methylbenzo[d]thiazol-2-yl)acetamide
CAS: 686772-17-8
CID: 2155264
Formula: C23H20N4O3S3
MW: 496.6
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight496.6
XLogP34.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Exact Mass496.06975403
Monoisotopic Mass496.06975403
Topological Polar Surface Area163 Ų
Heavy Atom Count33
Formal Charge0
Complexity851
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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