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461027-45-2

461027-45-2 structural image
Product Name: N-[[2-(4-chlorophenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]-4-methylbenzamide
Formula: C22H18ClN5OS
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COMPUTED DESCRIPTORS

Molecular Weight 435.9 g/mol
XLogP3 6.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 435.0920591 g/mol
Monoisotopic Mass 435.0920591 g/mol
Topological Polar Surface Area 104 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 621
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