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321392-12-5

321392-12-5 structural image
Product Name: 2-(2-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)ETHYL)-4-(1,3-DIOXO-1,3-DIHYDRO-2H-INDEN-2-YLIDEN)-6-(2-PYRIDINYL)TETRAHYDROPYRROLO[3,4-C]PYRROLE-1,3(2H,3AH)-DIONE
Formula: C28H19ClF3N5O4
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COMPUTED DESCRIPTORS

Molecular Weight 581.9 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 6
Exact Mass 581.1077663 g/mol
Monoisotopic Mass 581.1077663 g/mol
Topological Polar Surface Area 125 Ų
Heavy Atom Count 41
Formal Charge 0
Complexity 1160
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes