7-(4'-(2-nitroimidazole-1-yl)butyl)theophylline

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Names

[ CAS No. ]:
137046-51-6

[ Name ]:
7-(4'-(2-nitroimidazole-1-yl)butyl)theophylline

[Synonym ]:
1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-(4-(2-nitro-1H-imidazol-1-yl)butyl)
7-(4-(2-(Hydroxy(oxido)amino)-1H-imidazol-1-yl)butyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
NITP
7-(4'-(2-Nitroimidazole-1-yl)butyl)theophylline
7-<4-(2-nitroimidazol-1-yl)butyl>theophylline

Chemical & Physical Properties

[ Density]:
1.55g/cm3

[ Boiling Point ]:
665.2ºC at 760 mmHg

[ Molecular Formula ]:
C14H17N7O4

[ Molecular Weight ]:
347.32900

[ Flash Point ]:
356.1ºC

[ Exact Mass ]:
347.13400

[ PSA ]:
125.46000

[ LogP ]:
0.54200

[ Vapour Pressure ]:
1.46E-17mmHg at 25°C

[ Index of Refraction ]:
1.721

Synthetic Route

Precursor & DownStream

Precursor

  • 2-Nitroimidazole
  • 7-(4-chlorobutyl)-1,3-dimethylpurine-2,6-dione
  • 1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-, sodium salt (1:1)

DownStream


Related Compounds

  • 7-[2-{5-(pentan-1-yl)-1,2,4-oxadiazol-3-yl}-ethan-1-yl]-theophylline
  • 7,4'-Dihydroxy-3'-prenylflavan
  • 7-(4'-tert-Butyl-phenyl)-2-(1-adamantylmethyl)-indan-1-one
  • 7-(4'-tert-Butyl-phenyl)-2-(1-adamantylmethyl)-1H-indene
  • 7-[2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl]-1,3-dimethylpurine-2,6-dione
  • 7-[2-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]-1,3-dimethylpurine-2,6-dione,dihydrobromide
  • N-[2-(1,3-benzodioxol-5-ylcarbonyl)-1-benzofuran-3-yl]-3,4,5-trimethoxybenzamide
  • 4-(1,3-Dioxolan-2-yl)-4-methylpentan-1-amine
  • N-(3,4,5-trimethoxyphenyl)-2-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamide
  • 2-[3-(4-Bromo-phenyl)-ureido]-4-chloro-benzoic acid
  • 1'-allyl-6-methyl-2,3,4,9-tetrahydrospiro[beta-carboline-1,3'-indol]-2'(1'H)-one
  • N-[2-(6-ethyl-2-oxo-2H-chromen-4-yl)-1-benzofuran-3-yl]-3,4-dimethoxybenzamide
  • 2-(5,7-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]acetamide
  • 2-methoxy-N-[2-(2-oxo-2,6,7,8-tetrahydrocyclopenta[g]chromen-4-yl)-1-benzofuran-3-yl]benzamide
  • (Z)-5-((dimethylamino)methyl)-6-hydroxy-2-(4-methoxybenzylidene)-7-methylbenzofuran-3(2H)-one
  • (2S)-2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)amino]-3-phenylpropanoic acid
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