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Home > Encyclopedia > dimethyl 2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]benzene-1,4-dicarboxylate

dimethyl 2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]benzene-1,4-dicarboxylate

dimethyl 2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]benzene-1,4-dicarboxylate structure

dimethyl 2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]benzene-1,4-dicarboxylate 

structure
  • CAS No:

    730256-62-9

  • Formula:

    C17H16N2O6S

  • Chemical Name:

    dimethyl 2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]benzene-1,4-dicarboxylate

  • Synonyms:

    MLS000565026;CHEMBL1542861;HMS2466B06;ZINC3298109;AKOS033630716;SMR000152257;Z18546572;2-[({[2,5-bis(methoxycarbonyl)phenyl]carbamoyl}methyl)sulfanyl]pyridin-1-ium-1-olate;730256-62-9

dimethyl 2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]benzene-1,4-dicarboxylate Basic Attributes

376.4 g/mol

376.07290741 g/mol

Characteristics

133 Ų

Computed Properties

Molecular Weight:376.4
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:376.07290741
Monoisotopic Mass:376.07290741
Topological Polar Surface Area:133
Heavy Atom Count:26
Complexity:518
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of dimethyl 2-[[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]amino]benzene-1,4-dicarboxylate

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