338421-63-9
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 |