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799834-57-4

799834-57-4 structural image
Product Name: (7Z)-3-(3,4-dimethylphenyl)-7-(5-ethoxy-2-oxo-1H-indol-3-ylidene)-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
Formula: C23H22N4O3S
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COMPUTED DESCRIPTORS

Molecular Weight 434.5 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 434.14126175 g/mol
Monoisotopic Mass 434.14126175 g/mol
Topological Polar Surface Area 99.5 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 828
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 1
Compound Is Canonicalized Yes