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852375-78-1

852375-78-1 structural image
Product Name: ethyl (2-((3-(p-tolyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetyl)glycinate
Formula: C18H19N5O3S
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COMPUTED DESCRIPTORS

Molecular Weight 385.4 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 8
Exact Mass 385.12086066 g/mol
Monoisotopic Mass 385.12086066 g/mol
Topological Polar Surface Area 124 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 515
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