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840473-00-9

840473-00-9 structural image
Product Name: 4-[5-(3-methoxyphenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-N,N-dimethylaniline
Formula: C20H21N5O
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COMPUTED DESCRIPTORS

Molecular Weight 347.4 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 347.17461031 g/mol
Monoisotopic Mass 347.17461031 g/mol
Topological Polar Surface Area 55.2 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 502
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