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532418-90-9

532418-90-9 structural image
Product Name: N-{[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-4-(butan-2-yloxy)benzamide
Formula: C25H23N3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 461.5 g/mol
XLogP3 6
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 461.14092740 g/mol
Monoisotopic Mass 461.14092740 g/mol
Topological Polar Surface Area 129 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 672
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