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88468-00-2

88468-00-2 structural image
Product Name: Benzoic acid, 4-[[[[(4-butylphenyl)methyl]heptylamino]carbonyl]amino]-
Formula: C26H36N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 424.6 g/mol
XLogP3 6.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 13
Exact Mass 424.27259301 g/mol
Monoisotopic Mass 424.27259301 g/mol
Topological Polar Surface Area 69.6 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 509
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