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1449413-27-7

1449413-27-7 structural image
Product Name: N-(2-(1-((4-bromophenyl)sulfonyl)-1H-pyrrol-3-yl)-2-oxoethyl)-N-tosylformamide
Formula: C20H17BrN2O6S2
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COMPUTED DESCRIPTORS

Molecular Weight 525.4 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 523.97114 g/mol
Monoisotopic Mass 523.97114 g/mol
Topological Polar Surface Area 127 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 851
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