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852437-84-4

852437-84-4 structural image
Product Name: 2-((3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)-N-(5-methylisoxazol-3-yl)acetamide
Formula: C19H18N6O4S
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COMPUTED DESCRIPTORS

Molecular Weight 426.5 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 7
Exact Mass 426.11102425 g/mol
Monoisotopic Mass 426.11102425 g/mol
Topological Polar Surface Area 142 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 589
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

2-[[3-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]-N-(5-methyl-3-isoxazolyl)acetamide is a member of triazoles.