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477867-42-8

477867-42-8 structural image
Product Name: 4-[5-CHLORO-1-(3-CHLOROPHENYL)-6-OXO-1,6-DIHYDRO-4-PYRIDAZINYL]-N-(2-CYANO-4,5-DIMETHOXYPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOTHIOAMIDE
Formula: C24H22Cl2N6O3S
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COMPUTED DESCRIPTORS

Molecular Weight 545.4 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 544.0851151 g/mol
Monoisotopic Mass 544.0851151 g/mol
Topological Polar Surface Area 126 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 947
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