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Home > Encyclopedia > [2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 5-nitrofuran-2-carboxylate

[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 5-nitrofuran-2-carboxylate

[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 5-nitrofuran-2-carboxylate structure

[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 5-nitrofuran-2-carboxylate 

structure
  • CAS No:

    744258-18-2

  • Formula:

    C21H18N2O8

  • Chemical Name:

    [2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 5-nitrofuran-2-carboxylate

  • Synonyms:

    ZINC2635601;AKOS033697138;MCULE-5637873391;AB00981777-01;SR-01000051344;SR-01000051344-1;Z19638673;2-{1-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-oxoethyl 5-nitrofuran-2-carboxylate;744258-18-2

[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 5-nitrofuran-2-carboxylate Basic Attributes

426.4 g/mol

426.10631554 g/mol

Characteristics

126 Ų

Computed Properties

Molecular Weight:426.4
XLogP3:3.7
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:426.10631554
Monoisotopic Mass:426.10631554
Topological Polar Surface Area:126
Heavy Atom Count:31
Complexity:697
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 5-nitrofuran-2-carboxylate

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