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113981-16-1

113981-16-1 structural image
Product Name: 5H-Thiazolo[3,2-a]pyrimidin-5-one, 6-[2-[4-(4-nitrobenzoyl)-1-piperidinyl]ethyl]-2,3-dihydro-7-methyl-
Formula: C21H24N4O4S
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COMPUTED DESCRIPTORS

Molecular Weight 428.5 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 428.15182643 g/mol
Monoisotopic Mass 428.15182643 g/mol
Topological Polar Surface Area 124 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 774
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