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343375-05-3

343375-05-3 structural image
Product Name: N-(2-CYANO-4,5-DIMETHOXYPHENYL)-N'-[4-(4-METHYLPIPERAZINO)PHENYL]THIOUREA
Formula: C21H25N5O2S
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COMPUTED DESCRIPTORS

Molecular Weight 411.5 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 411.17289623 g/mol
Monoisotopic Mass 411.17289623 g/mol
Topological Polar Surface Area 105 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 581
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