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Famciclovir-[d4]

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Category Herpes simplex Virus (HSV)
CAS 1020719-42-9
Description Famciclovir-[d4] is the labelled analogue of Famciclovir, which is used for the treatment of various herpesvirus infections, most commonly for herpes zoster.
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Product Information

Synonyms Famciclovir-d4; 2-[2-(2-Amino-9H-purin-9-yl)ethyl]-1,3-propanediol Diacetate Ester-d4; 9-[4-Acetoxy-3-(acetoxymethyl)but-1-yl]-2-aminopurine-d4; 9-[4-Acetoxy-3-(acetoxymethyl)butyl]-2-aminopurine-d4; BRL 42810-d4; FCV-d4; Famcivir-d4; Famcyclovir-d4; Famtrex-d4; Famvir-d4
IUPAC Name [2-(acetyloxymethyl)-4-(2-aminopurin-9-yl)-3,3,4,4-tetradeuteriobutyl] acetate
Molecular Weight 325.36
Molecular Formula C4H15D4N5O4
Canonical SMILES CC(=O)OCC(CCN1C=NC2=CN=C(N=C21)N)COC(=O)C
InChI InChI=1S/C14H19N5O4/c1-9(20)22-6-11(7-23-10(2)21)3-4-19-8-17-12-5-16-14(15)18-13(12)19/h5,8,11H,3-4,6-7H2,1-2H3,(H2,15,16,18)/i3D2,4D2
InChIKey GGXKWVWZWMLJEH-KHORGVISSA-N
Melting Point 101-103°C
Purity ≥98%; ≥99% atom D
Solubility Soluble in DMSO (Slightly), Methanol (Very Slightly)
Appearance Off-white to Pale Beige Solid
Storage Store at -20°C
Complexity 404
Exact Mass 325.16881109
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 122.22000
Target HSV
XLogP3-AA 0

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