Gs-39783

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Properties Simple | Detailed

Formula C15H23N5O2S
IUPAC Name n4,n6-dicyclopentyl-2-methylsulfanyl-5-nitro-pyrimidine-4,6-diamine
Molecular Mass 337.440 g·mol−1
Heat of Formation -48.3 ± 16.7 kJ·mol−1
Dipole Moment 2.67 ± 1.08 D
Volume 399.99 Å 3
Surface Area 350.72 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • cyclopentyl-[6-(cyclopentylamino)-2-(methylthio)-5-nitro-pyrimidin-4-yl]amine
  • gs39783
  • n,n′-dicyclopentyl-2-methylsulfanyl-5-nitro-pyrimidine-4,6-diamine
  • n,n'-dicyclopentyl-2-(methylthio)-5-nitropyrimidine-4,6-diamine
  • n,n'-dicyclopentyl-2-methylsulfanyl-5-nitro-pyrimidine-4,6-diamine
  • n,n'-dicyclopentyl-2-methylsulfanyl-5-nitropyrimidine-4,6-diamine
  • pdsp1_000401
  • pdsp2_000399
  • tocris-2001
InChIKey GSGVDKOCBKBMGG-UHFFFAOYSA-N
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