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852167-23-8

852167-23-8 structural image
Product Name: ethyl (2-((5-(1H-indol-3-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetyl)glycinate
Formula: C23H23N5O4S
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COMPUTED DESCRIPTORS

Molecular Weight 465.5 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 10
Exact Mass 465.14707541 g/mol
Monoisotopic Mass 465.14707541 g/mol
Topological Polar Surface Area 136 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 663
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