1H-Purine-2,6-dione,3,7-dihydro-1,3,7-trimethyl-8-[(phenylmethyl)thio]-

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Names

[ CAS No. ]:
24851-28-3

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

[Synonym ]:
1,3,7-trimethyl-8-(benzylthio)xanthine
8-Benzylthiocoffein
8-Benzylmercapto-1,3,7-trimethyl-3,7-dihydro-purin-2,6-dion
8-benzylsulfanyl-1,3,7-trimethyl-3,7-dihydro-purine-2,6-dione
8-(Benzylsulfanyl)Caffeine
8-benzylmercapto-1,3,7-trimethyl-3,7-dihydro-purine-2,6-dione

Chemical & Physical Properties

[ Density]:
1.36g/cm3

[ Boiling Point ]:
532.5ºC at 760mmHg

[ Molecular Formula ]:
C15H16N4O2S

[ Molecular Weight ]:
316.37800

[ Flash Point ]:
275.8ºC

[ Exact Mass ]:
316.09900

[ PSA ]:
87.12000

[ LogP ]:
1.26300

[ Vapour Pressure ]:
2.03E-11mmHg at 25°C

[ Index of Refraction ]:
1.681

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Dibenzyl disulfide
  • Caffeine
  • 1H-Purine-2,6-dione,8-chloro-3,7-dihydro-1,3,7-trimethyl-
  • benzylthiol

DownStream

Related Compounds

  • 1-(6-(1H-imidazol-1-yl)pyridazin-3-yl)-N-(thiazol-2-yl)piperidine-3-carboxamide
  • 1-(6-(1H-imidazol-1-yl)pyridazin-3-yl)-N-(5-methylisoxazol-3-yl)piperidine-3-carboxamide
  • 1-(6-(1H-imidazol-1-yl)pyridazin-3-yl)-N-(3-fluorophenyl)piperidine-3-carboxamide
  • 1-(6-(1H-imidazol-1-yl)pyridazin-3-yl)-N-(2-chlorophenyl)piperidine-3-carboxamide
  • 1-(6-(1H-imidazol-1-yl)pyridazin-3-yl)-N-(naphthalen-1-yl)piperidine-3-carboxamide
  • 1-(6-(1H-imidazol-1-yl)pyridazin-3-yl)-N-(3-fluoro-4-methylphenyl)piperidine-3-carboxamide
  • 1-(6-(1H-imidazol-1-yl)pyridazin-3-yl)-N-(4-bromo-2-fluorophenyl)piperidine-3-carboxamide
  • 1-(6-(1H-imidazol-1-yl)pyridazin-3-yl)-N-(2-(1H-indol-3-yl)ethyl)piperidine-3-carboxamide
  • 1-(6-(1H-imidazol-1-yl)pyridazin-3-yl)-N-(2-(methylthio)phenyl)piperidine-3-carboxamide
  • 1-(6-(1H-imidazol-1-yl)pyridazin-3-yl)-N-(2-methoxy-5-(trifluoromethyl)phenyl)piperidine-3-carboxamide
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