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1111485-98-3

1111485-98-3 structural image
Product Name: Thieno[3,2-c]pyridine-5(4H)-ethanol, α-[(2,6-dichlorophenoxy)methyl]-6,7-dihydro-
Formula: C16H17Cl2NO2S
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COMPUTED DESCRIPTORS

Molecular Weight 358.3 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 357.0357053 g/mol
Monoisotopic Mass 357.0357053 g/mol
Topological Polar Surface Area 60.9 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 353
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes