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672950-67-3

672950-67-3 structural image
Product Name: 4-((4-[5-(BENZYLSULFANYL)-4-ETHYL-4H-1,2,4-TRIAZOL-3-YL]PIPERIDINO)SULFONYL)PHENYL METHYL ETHER
Formula: C23H28N4O3S2
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COMPUTED DESCRIPTORS

Molecular Weight 472.6 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 8
Exact Mass 472.16028312 g/mol
Monoisotopic Mass 472.16028312 g/mol
Topological Polar Surface Area 111 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 667
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