338421-61-7
Product Name:
4-BROMO-N-((5-[(4-BROMOBENZYL)SULFANYL]-4-METHYL-4H-1,2,4-TRIAZOL-3-YL)METHYL)BENZENESULFONAMIDE
Formula:
C17H16Br2N4O2S2
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COMPUTED DESCRIPTORS
Molecular Weight | 532.3 g/mol |
---|---|
XLogP3 | 3.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 7 |
Exact Mass | 531.90609 g/mol |
Monoisotopic Mass | 529.90814 g/mol |
Topological Polar Surface Area | 111 Ų |
Heavy Atom Count | 27 |
Formal Charge | 0 |
Complexity | 562 |
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 |