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339278-10-3

339278-10-3 structural image
Product Name: 2-(2-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)ETHYL)-4-NITRO-1H-ISOINDOLE-1,3(2H)-DIONE
Formula: C16H10ClF3N4O4
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COMPUTED DESCRIPTORS

Molecular Weight 414.72 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 4
Exact Mass 414.0342670 g/mol
Monoisotopic Mass 414.0342670 g/mol
Topological Polar Surface Area 108 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 644
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