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Homecas2094559-58-5

2094559-58-5

2094559-58-5 structural image
Product Name: Brexpiprazole Impurity 2
Formula: C38H40N4O4S
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COMPUTED DESCRIPTORS

Molecular Weight 648.8 g/mol
XLogP3 6.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 13
Exact Mass 648.27702694 g/mol
Monoisotopic Mass 648.27702694 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 47
Formal Charge 0
Complexity 1110
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

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