1H-Purine-2,6-dione,3,7-dihydro-8-(isothiocyanatomethyl)-1,3-dimethyl-7-(phenylmethyl)-

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Names

[ CAS No. ]:
27042-79-1

[ Name ]:
1H-Purine-2,6-dione,3,7-dihydro-8-(isothiocyanatomethyl)-1,3-dimethyl-7-(phenylmethyl)-

[Synonym ]:
7-benzyl-8-(isothiocyanatomethyl)-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione
8-Isothiocyanatomethyl-7-benzyltheophyllin
7-benzyl-8-isothiocyanatomethyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione

Chemical & Physical Properties

[ Density]:
1.37g/cm3

[ Boiling Point ]:
556.4ºC at 760mmHg

[ Molecular Formula ]:
C16H15N5O2S

[ Molecular Weight ]:
341.38800

[ Flash Point ]:
290.3ºC

[ Exact Mass ]:
341.09500

[ PSA ]:
106.27000

[ LogP ]:
1.08480

[ Vapour Pressure ]:
2.04E-12mmHg at 25°C

[ Index of Refraction ]:
1.694

Related Compounds

  • N-(2,5-difluorophenyl)-2-((2-methyl-6-(1H-pyrazol-1-yl)pyrimidin-4-yl)oxy)acetamide
  • 1-(4-(4-methoxyphenyl)piperazin-1-yl)-2-((2-methyl-6-(1H-pyrazol-1-yl)pyrimidin-4-yl)oxy)ethanone
  • N-(3-(1H-imidazol-1-yl)propyl)-2-((2-methyl-6-(1H-pyrazol-1-yl)pyrimidin-4-yl)oxy)acetamide
  • 2-((6-(1H-pyrazol-1-yl)pyridazin-3-yl)oxy)-N-(4-(trifluoromethoxy)phenyl)acetamide
  • 2-((6-(1H-pyrazol-1-yl)pyridazin-3-yl)oxy)-N-(4-fluorobenzyl)acetamide
  • 2-ethoxy-N-(3-hydroxycyclohexyl)-1-naphthamide
  • 2-((6-(1H-pyrazol-1-yl)pyridazin-3-yl)oxy)-N-phenylacetamide
  • 2-((6-(1H-pyrazol-1-yl)pyridazin-3-yl)oxy)-N-(2-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidin-5-yl)acetamide
  • 2-((6-(1H-pyrazol-1-yl)pyridazin-3-yl)oxy)-1-(4-(6-(piperidin-1-yl)pyridazin-3-yl)piperazin-1-yl)ethanone
  • (1-(Methylsulfonyl)piperidin-4-yl)(3-(methylsulfonyl)pyrrolidin-1-yl)methanone
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