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845650-12-6

845650-12-6 structural image
Product Name: 2-(4-chlorophenyl)-5-(3,4,5-trimethoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Formula: C25H23ClN2O4
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COMPUTED DESCRIPTORS

Molecular Weight 450.9 g/mol
XLogP3 5.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 450.1346349 g/mol
Monoisotopic Mass 450.1346349 g/mol
Topological Polar Surface Area 52.5 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 656
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes