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790271-09-9

790271-09-9 structural image
Product Name: Propanoic acid, 3-[[(1,4,5,6,7,8-hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl)methyl]thio]-
Formula: C14H16N2O3S2
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COMPUTED DESCRIPTORS

Molecular Weight 324.4 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 324.06023472 g/mol
Monoisotopic Mass 324.06023472 g/mol
Topological Polar Surface Area 132 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 469
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