2,4-Diamino-5-((2-Naphthylthio)Methyl)Furo(2,3-D)Pyrimidine

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Properties Simple | Detailed

Formula C17H14N4OS
IUPAC Name 5-(2-naphthylsulfanylmethyl)furo[2,3-d]pyrimidine-2,4-diamine
Molecular Mass 322.384 g·mol−1
Heat of Formation 252.3 ± 16.7 kJ·mol−1
Dipole Moment 4.04 ± 1.08 D
Volume 362.05 Å 3
Surface Area 328.1 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(2-naphthylsulfanylmethyl)furo[3,2-e]pyrimidine-2,4-diamine
  • 5-(naphthalen-2-ylsulfanylmethyl)-furo[2,3-d]pyrimidine-2,4-diamine
  • 5-(naphthalen-2-ylsulfanylmethyl)furo[3,2-e]pyrimidine-2,4-diamine
  • 5-[(2-naphthylthio)methyl]furo[3,2-e]pyrimidine-2,4-diamine
  • [2-amino-5-[(2-naphthylthio)methyl]furo[3,2-e]pyrimidin-4-yl]amine
InChIKey YGXJSXPQWMYNEJ-UHFFFAOYSA-N
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