N-(8-Methoxypyrimido[5,4-D]Pyrimidin-4-Yl)-β-D-Ribofuranosylamine

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Properties Simple | Detailed

Formula C12H15N5O5
IUPAC Name (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[(4-methoxypyrimido[5,4-d]pyrimidin-8-yl)amino]tetrahydrofuran-3,4-diol
Molecular Mass 309.278 g·mol−1
Heat of Formation -588.4 ± 16.7 kJ·mol−1
Dipole Moment 5.12 ± 1.08 D
Volume 333.39 Å 3
Surface Area 304.23 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -1.19 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r)-2-[(4-methoxypyrimido[6,5-e]pyrimidin-8-yl)amino]-5-methylol-tetrahydrofuran-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[(4-methoxy-8-pyrimido[6,5-e]pyrimidinyl)amino]tetrahydrofuran-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[(4-methoxypyrimido[6,5-e]pyrimidin-8-yl)amino]oxolane-3,4-diol
  • (2r,3s,4r,5r)-2-(hydroxymethyl)-5-[(4-methoxypyrimido[6,5-e]pyrimidin-8-yl)amino]tetrahydrofuran-3,4-diol
  • 4-methoxy-8-(ribofuranosylamino)pyrimido(5,4-d)pyrimidine
  • beta-d-ribofuranosylamine, n-(8-methoxypyrimido(5,4-d)pyrimidin-4-yl)-
  • mrpp
CAS Number(s)
  • 118515-48-3
InChIKey GJKFEQPZRZBOJH-JJNLEZRASA-N
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