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107952-07-8

107952-07-8 structural image
Product Name: 2,4-Dihydro-4-(3-chlorophenyl)-5-((2-methoxyphenoxy)methyl)-3H-1,2,4-t riazole-3-thione
Formula: C16H14ClN3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 347.8 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 347.0495256 g/mol
Monoisotopic Mass 347.0495256 g/mol
Topological Polar Surface Area 78.2 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 463
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