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383145-60-6

383145-60-6 structural image
Product Name: 4-PHENYL-5-([3-(TRIFLUOROMETHYL)PHENOXY]METHYL)-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE
Formula: C16H12F3N3OS
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COMPUTED DESCRIPTORS

Molecular Weight 351.3 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 351.06531767 g/mol
Monoisotopic Mass 351.06531767 g/mol
Topological Polar Surface Area 69 Ų
Heavy Atom Count 24
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