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496969-34-7

496969-34-7 structural image
Product Name: 4-(1H-benzimidazol-2-ylsulfanyl)-6-ethylthieno[2,3-d]pyrimidine
Formula: C15H12N4S2
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COMPUTED DESCRIPTORS

Molecular Weight 312.4 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 312.05033875 g/mol
Monoisotopic Mass 312.05033875 g/mol
Topological Polar Surface Area 108 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 370
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