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Penciclovir-[d4]

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Category Herpes simplex Virus (HSV)
CAS 1020719-72-5
Description Penciclovir-[d4] is the labelled analogue of Penciclovir, which is a guanosine analogue antiviral drug used for the treatment of various herpesvirusinfections.
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Product Information

Synonyms Penciclovir D4
IUPAC Name 2-amino-9-[1,1,2,2-tetradeuterio-4-hydroxy-3-(hydroxymethyl)butyl]-1H-purin-6-one
Molecular Weight 257.28
Molecular Formula C10H11D4N5O3
Canonical SMILES C1=NC2=C(N1CCC(CO)CO)N=C(NC2=O)N
InChI InChI=1S/C10H15N5O3/c11-10-13-8-7(9(18)14-10)12-5-15(8)2-1-6(3-16)4-17/h5-6,16-17H,1-4H2,(H3,11,13,14,18)/i1D2,2D2
InChIKey JNTOCHDNEULJHD-LNLMKGTHSA-N
Purity 95% by HPLC; 95% atom D
Density 1.7±0.1 g/cm3
Solubility In vitro:
10 mM in DMSO
Appearance Solid powder
Storage Store at -20°C
Complexity 344
Exact Mass 257.14259634
In Vitro Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and Metabolic profiles of drugs.
PSA 131.04000
Target HSV
XLogP3-AA -1.9

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