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778-97-2

778-97-2 structural image
Product Name: Ethyl 4-amino-2-(ethylthio)-5-pyrimidinecarboxylate
Formula: C9H13N3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 227.29 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 227.07284784 g/mol
Monoisotopic Mass 227.07284784 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 216
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