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672281-18-4

672281-18-4 structural image
Product Name: 4-butyl-7-hydroxy-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine-9(8H)-thione
Formula: C16H17N3OS2
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COMPUTED DESCRIPTORS

Molecular Weight 331.5 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 331.08130452 g/mol
Monoisotopic Mass 331.08130452 g/mol
Topological Polar Surface Area 114 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 486
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