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845991-35-7

845991-35-7 structural image
Product Name: 1-[[2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)phenyl]methyl]-3-phenylurea
Formula: C24H22N4O2
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COMPUTED DESCRIPTORS

Molecular Weight 398.5 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 398.17427596 g/mol
Monoisotopic Mass 398.17427596 g/mol
Topological Polar Surface Area 73.8 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 658
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