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866138-26-3

866138-26-3 structural image
Product Name: 5-(4-METHOXYBENZOYL)-8-(TRIFLUOROMETHYL)-1,3,4,5-TETRAHYDRO-2H-1,5-BENZODIAZEPIN-2-ONE
Formula: C18H15F3N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 364.3 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 2
Exact Mass 364.10347683 g/mol
Monoisotopic Mass 364.10347683 g/mol
Topological Polar Surface Area 58.6 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 532
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