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575460-93-4

575460-93-4 structural image
Product Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-5-(3-methoxyphenyl)-1,2,4-triazol-4-amine
Formula: C16H14Cl2N4OS
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COMPUTED DESCRIPTORS

Molecular Weight 381.3 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 380.0265376 g/mol
Monoisotopic Mass 380.0265376 g/mol
Topological Polar Surface Area 91.3 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 408
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