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1704080-83-0

1704080-83-0 structural image
Product Name: (3-((4-ethylpiperazin-1-yl)sulfonyl)-4-Methoxyphenyl)boronic acid
Formula: C13H21BN2O5S
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COMPUTED DESCRIPTORS

Molecular Weight 328.2 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 328.1264231 g/mol
Monoisotopic Mass 328.1264231 g/mol
Topological Polar Surface Area 98.7 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 448
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