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2131091-31-9

2131091-31-9 structural image
Product Name: tert-butyl 2-methyl-2-(5-methyl-6-(oxazol-2-yl)-2,4-dioxo-1,2-dihydrothieno[2,3-d]pyrimidin-3(4H)-yl)propanoate
Formula: C18H21N3O5S
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COMPUTED DESCRIPTORS

Molecular Weight 391.4 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 391.12019195 g/mol
Monoisotopic Mass 391.12019195 g/mol
Topological Polar Surface Area 130 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 647
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

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