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1022130-08-0

1022130-08-0 structural image
Product Name: 1-(((4-(5-CHLORO-2-METHYLPHENYL)PIPERAZINYL)SULFONYL)METHYL)-7,7-DIMETHYLBICYCLO[2.2.1]HEPTAN-2-ONE
Formula: C21H29ClN2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 425.0 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 424.1587417 g/mol
Monoisotopic Mass 424.1587417 g/mol
Topological Polar Surface Area 66.1 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 726
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes