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1010912-28-3

1010912-28-3 structural image
Product Name: N-[3-(benzenesulfonyl)-1-(3-methoxypropyl)-4,5-dimethylpyrrol-2-yl]pyridine-4-carboxamide
Formula: C22H25N3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 427.5 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 8
Exact Mass 427.15657746 g/mol
Monoisotopic Mass 427.15657746 g/mol
Topological Polar Surface Area 98.7 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 654
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