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338409-09-9

338409-09-9 structural image
Product Name: ETHYL 6-(4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]PIPERAZINO)-5-CYANO-2-OXO-1,2-DIHYDRO-3-PYRIDINECARBOXYLATE
Formula: C19H17ClF3N5O3
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COMPUTED DESCRIPTORS

Molecular Weight 455.8 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 5
Exact Mass 455.0972016 g/mol
Monoisotopic Mass 455.0972016 g/mol
Topological Polar Surface Area 98.6 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 843
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