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799839-56-8

799839-56-8 structural image
Product Name: (7Z)-7-(5-methoxy-2-oxo-1H-indol-3-ylidene)-3-[3-(trifluoromethyl)phenyl]-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
Formula: C21H15F3N4O3S
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COMPUTED DESCRIPTORS

Molecular Weight 460.4 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 2
Exact Mass 460.08169601 g/mol
Monoisotopic Mass 460.08169601 g/mol
Topological Polar Surface Area 99.5 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 877
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