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67618-23-9

67618-23-9 structural image
Product Name: N-(1,3-BENZODIOXOL-5-YL)-N'-BENZOYLTHIOUREA
Formula: C15H12N2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 300.3 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 300.05686342 g/mol
Monoisotopic Mass 300.05686342 g/mol
Topological Polar Surface Area 91.7 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 398
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