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843630-05-7

843630-05-7 structural image
Product Name: 7-(3-chlorophenyl)-5-(4-methylphenyl)-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Formula: C18H18ClN5
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COMPUTED DESCRIPTORS

Molecular Weight 339.8 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 339.1250733 g/mol
Monoisotopic Mass 339.1250733 g/mol
Topological Polar Surface Area 68.8 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 428
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