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Home > Encyclopedia > 3-O-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate

3-O-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate

3-O-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate structure

3-O-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate 

structure
  • CAS No:

    744245-21-4

  • Formula:

    C25H22N2O9

  • Chemical Name:

    3-O-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate

  • Synonyms:

    ZINC2635533;AKOS033627325;MCULE-8883807996;Z18511083;1-(2-{1-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-oxoethyl) 3-methyl 5-nitrobenzene-1,3-dicarboxylate;744245-21-4

3-O-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Basic Attributes

494.4 g/mol

494.13253028 g/mol

Characteristics

139 Ų

Computed Properties

Molecular Weight:494.4
XLogP3:3.8
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:9
Exact Mass:494.13253028
Monoisotopic Mass:494.13253028
Topological Polar Surface Area:139
Heavy Atom Count:36
Complexity:846
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 3-O-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate

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