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840469-98-9

840469-98-9 structural image
Product Name: 1'-ethyl-2-(4-phenylphenyl)spiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
Formula: C28H29N3O
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COMPUTED DESCRIPTORS

Molecular Weight 423.5 g/mol
XLogP3 5.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 423.231062557 g/mol
Monoisotopic Mass 423.231062557 g/mol
Topological Polar Surface Area 28.1 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 670
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