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96818-57-4

96818-57-4 structural image
Product Name: TIMTEC-BB SBB009861
Formula: C12H10N2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 246.29 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 246.04629874 g/mol
Monoisotopic Mass 246.04629874 g/mol
Topological Polar Surface Area 89.9 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 296
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes