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861211-08-7

861211-08-7 structural image
Product Name: 1-[3-NITRO-4-((2-[2-(2-PYRIDINYL)-1,3-THIAZOL-4-YL]ETHYL)AMINO)PHENYL]-1-ETHANONE
Formula: C18H16N4O3S
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COMPUTED DESCRIPTORS

Molecular Weight 368.4 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 368.09431156 g/mol
Monoisotopic Mass 368.09431156 g/mol
Topological Polar Surface Area 129 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 501
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