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477766-88-4

477766-88-4 structural image
Product Name: 4-(5-[(4-CHLORO-3-NITROPHENYL)METHYLENE]-4-OXO-2-THIOXO-1,3-THIAZOLAN-3-YL)-4-AZATRICYCLO[5.2.1.0(2,6)]DEC-8-ENE-3,5-DIONE
Formula: C19H12ClN3O5S2
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COMPUTED DESCRIPTORS

Molecular Weight 461.9 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 1
Exact Mass 460.9906905 g/mol
Monoisotopic Mass 460.9906905 g/mol
Topological Polar Surface Area 161 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 917
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 4
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes