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Home > Encyclopedia > [2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-chloro-2-nitrobenzoate

[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-chloro-2-nitrobenzoate

[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-chloro-2-nitrobenzoate structure

[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-chloro-2-nitrobenzoate 

structure
  • CAS No:

    744235-10-7

  • Formula:

    C23H19ClN2O7

  • Chemical Name:

    [2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-chloro-2-nitrobenzoate

  • Synonyms:

    ZINC2634899;AKOS033707080;MCULE-1988110277;Z19773496;2-{1-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-oxoethyl 4-chloro-2-nitrobenzoate;744235-10-7

[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-chloro-2-nitrobenzoate Basic Attributes

470.9 g/mol

470.0880786 g/mol

Characteristics

113 Ų

Computed Properties

Molecular Weight:470.9
XLogP3:4.6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:470.0880786
Monoisotopic Mass:470.0880786
Topological Polar Surface Area:113
Heavy Atom Count:33
Complexity:747
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] 4-chloro-2-nitrobenzoate

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