Valaciclovir

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Properties Simple | Detailed

Formula C13H21N6O4
IUPAC Name 2-[(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)methoxy]ethyl (2s)-2-amino-3-methyl-butanoate
Molecular Mass 325.344 g·mol−1
Heat of Formation -526.0 ± 16.7 kJ·mol−1
Dipole Moment 6.49 ± 1.08 D
Volume 384.92 Å 3
Surface Area 314.26 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-methyl-butyric acid 2-[(2-amino-6-keto-3h-purin-9-yl)methoxy]ethyl ester
  • (2s)-2-amino-3-methylbutanoic acid 2-[(2-amino-6-oxo-3h-purin-9-yl)methoxy]ethyl ester
  • 124832-27-5 (hydrochloride)
  • 2-[(2-amino-6-oxo-1,6-dihydro-9h-purin-9-yl)methoxy]ethyl l-valinate
  • 2-[(2-amino-6-oxo-3h-purin-9-yl)methoxy]ethyl (2s)-2-amino-3-methyl-butanoate
  • 2-[(2-amino-6-oxo-3h-purin-9-yl)methoxy]ethyl (2s)-2-amino-3-methylbutanoate
  • 2-{[(2-amino-6-oxo-1,6-dihydro-9h-purin-9-yl)methyl]oxy}ethyl l-valinate
  • 256u87
  • acyclovir-valine
  • bw-256u
  • bw256u87
  • ks-1126
  • l-valine ester with 9-((2-hydroxyethoxy)methyl)guanine
  • l-valine, 2-((2-amino-1,6-dihydro-6-oxo-9h-purin-9-yl)methoxy)ethyl ester
  • talavir
  • vacv
  • valaciclovir, valtrex
  • valacv
  • valacyclovir
  • virval
  • zelitrex
CAS Number(s)
  • 124832-26-4
InChIKey HDOVUKNUBWVHOX-QMMMGPOBSA-N
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