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686770-61-6

686770-61-6 structural image
Product Name: IWP-2
Formula: C22H18N4O2S3
Synonyms: Inhibitor of Wnt Production-2, Wnt Pathway Inhibitor II, Porcn Inhibitor I;InSolution Wnt Antagonist II, IWP-2 - CAS 686770-61-6 - Calbiochem;N-(6-Methyl-2-benzothiazolyl)-2-[(3,4,6,7-tetrahydro-4-oxo-3-phenylthieno[3,2-d]pyrimidin-2-yl)thio]-acetamide;Wnt Antagonist II, IWP-2 - CAS 686770-61-6 - Calbiochem
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COMPUTED DESCRIPTORS

Molecular Weight 466.6 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 466.05918935 g/mol
Monoisotopic Mass 466.05918935 g/mol
Topological Polar Surface Area 154 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 796
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

N-(6-methyl-1,3-benzothiazol-2-yl)-2-[(4-oxo-3-phenyl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)thio]acetamide is an organonitrogen heterocyclic compound, an organic heterobicyclic compound and an organosulfur heterocyclic compound.