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320417-53-6

320417-53-6 structural image
Product Name: 4-(4-CHLOROPHENYL)-6-(DIMETHYLAMINO)-2-(3-PYRIDINYL)-5-PYRIMIDINECARBONITRILE
Formula: C18H14ClN5
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COMPUTED DESCRIPTORS

Molecular Weight 335.8 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 335.0937732 g/mol
Monoisotopic Mass 335.0937732 g/mol
Topological Polar Surface Area 65.7 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 454
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