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849027-63-0

849027-63-0 structural image
Product Name: N-(2-ethoxyphenyl)-2-[[5-[(4-methylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Formula: C23H26N4O3S
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COMPUTED DESCRIPTORS

Molecular Weight 438.5 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 11
Exact Mass 438.17256188 g/mol
Monoisotopic Mass 438.17256188 g/mol
Topological Polar Surface Area 104 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 559
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