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879621-89-3

879621-89-3 structural image
Product Name: 4-(4-chlorophenyl)-2-(4-methoxyanilino)-8-methyl-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Formula: C20H18ClN5O2
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COMPUTED DESCRIPTORS

Molecular Weight 395.8 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 395.1149025 g/mol
Monoisotopic Mass 395.1149025 g/mol
Topological Polar Surface Area 78.3 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 691
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes