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885273-77-8

885273-77-8 structural image
Product Name: 1-OXO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-7-SULFONIC ACID AMIDE
Formula: C9H10N2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 226.25 g/mol
XLogP3 -0.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 226.04121336 g/mol
Monoisotopic Mass 226.04121336 g/mol
Topological Polar Surface Area 97.6 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 360
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