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476318-46-4

476318-46-4 structural image
Product Name: methyl 3,6-diamino-4-(4-chlorophenyl)-5-cyanothieno[2,3-b]pyridine-2-carboxylate
Formula: C16H11ClN4O2S
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COMPUTED DESCRIPTORS

Molecular Weight 358.8 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 358.0291245 g/mol
Monoisotopic Mass 358.0291245 g/mol
Topological Polar Surface Area 143 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 533
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