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899940-51-3

899940-51-3 structural image
Product Name: 5-amino-1-[(2,5-dimethylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]triazole-4-carboxamide
Formula: C20H23N5O2
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COMPUTED DESCRIPTORS

Molecular Weight 365.4 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 365.18517499 g/mol
Monoisotopic Mass 365.18517499 g/mol
Topological Polar Surface Area 95.1 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 491
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes