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1139547-68-4

1139547-68-4 structural image
Product Name: Isoxazole, 5-[4-[4,5-dihydro-2-(2-methylphenyl)-4-oxazolyl]phenyl]-4,5-dihydro-3-phenyl-
Formula: C25H22N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 382.5 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 382.168127949 g/mol
Monoisotopic Mass 382.168127949 g/mol
Topological Polar Surface Area 43.2 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 616
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