3-(3-Cyclopentyloxy-4-Methoxybenzyl)-6-Ethylamino-8-Isopropyl-3H-Purine

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Properties Simple | Detailed

Formula C23H31N5O2
IUPAC Name 3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-n-ethyl-8-isopropyl-purin-6-amine
Molecular Mass 409.525 g·mol−1
Heat of Formation -79.9 ± 16.7 kJ·mol−1
Dipole Moment 1.69 ± 1.08 D
Volume 512.69 Å 3
Surface Area 426.22 Å 2
HOMO Energy -8.19 ± 0.55 eV
LUMO Energy -0.57 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-n-ethyl-8-propan-2-yl-purin-6-amine
  • 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-n-ethyl-8-propan-2-ylpurin-6-amine
  • 3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-n-ethyl-8-isopropyl-purin-6-amine
  • 3-[[3-(cyclopentoxy)-4-methoxyphenyl]methyl]-n-ethyl-8-isopropyl-6-purinamine
  • [3-[3-(cyclopentoxy)-4-methoxy-benzyl]-8-isopropyl-purin-6-yl]-ethyl-amine
InChIKey CGFRGBQJWVFTRF-UHFFFAOYSA-N
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