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338421-63-9

338421-63-9 structural image
Product Name: 4-BROMO-N-((5-[(3-CHLOROBENZYL)SULFANYL]-4-METHYL-4H-1,2,4-TRIAZOL-3-YL)METHYL)BENZENESULFONAMIDE
Formula: C17H16BrClN4O2S2
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COMPUTED DESCRIPTORS

Molecular Weight 487.8 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 485.95866 g/mol
Monoisotopic Mass 485.95866 g/mol
Topological Polar Surface Area 111 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 572
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