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55507-28-3

55507-28-3 structural image
Product Name: Indeno[1,2-d]triazol-8(3H)-one, 3a,8a-dihydro-3-(4-methoxyphenyl)-
Formula: C16H13N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 279.29 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 279.100776666 g/mol
Monoisotopic Mass 279.100776666 g/mol
Topological Polar Surface Area 54.3 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 445
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes