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799785-98-1

799785-98-1 structural image
Product Name: 6-(1-benzylindol-3-yl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Formula: C32H33N3O
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COMPUTED DESCRIPTORS

Molecular Weight 475.6 g/mol
XLogP3 6.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 475.262362685 g/mol
Monoisotopic Mass 475.262362685 g/mol
Topological Polar Surface Area 46.1 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 858
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