6-[(4-Bromo-2-Thienyl)Methoxy]-7H-Purin-2-Amine

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Properties Simple | Detailed

Formula C10H8BrN5OS
IUPAC Name 6-[(4-bromo-2-thienyl)methoxy]purin-7-ium-2-amine
Molecular Mass 326.172 g·mol−1
Heat of Formation 282.8 ± 16.7 kJ·mol−1
Dipole Moment 4.28 ± 1.08 D
Volume 299.23 Å 3
Surface Area 283.82 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 1.92 ± eV
Point Group Symmetry C1
Synonyms
  • 6-(4-bromothenyloxy)-7h-purin-2-amine
  • [6-[(4-bromo-2-thienyl)methoxy]-7h-purin-2-yl]amine
  • lomeguatrib
CAS Number(s)
  • 192441-08-0
InChIKey JUJPKFNFCWJBCX-UHFFFAOYSA-N
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Elements C H O N S Br