Tenofovir-C3-O-C15-CF3 ammonium

Category	Human immunodeficiency Virus (HIV)
CAS	2611373-80-7
Description	Tenofovir-C3-O-C15-CF3 ammonium shows substantially longer t1/2 values than tenofovir in human liver microsomes, and has strong anti-HIV activity in vitro and enhances pharmacokinetic properties in vivo.

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Synonyms	ammonium 3-((16,16,16-trifluorohexadecyl)oxy)propyl (R)-(((1-(6-amino-9H-purin-9-yl)propan-2-yl)oxy)methyl)phosphonate
IUPAC Name	azanium;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[3-(16,16,16-trifluorohexadecoxy)propoxy]phosphinate
Molecular Weight	640.72
Molecular Formula	C28H52F3N6O5P
Canonical SMILES	CC(CN1C=NC2=C(N=CN=C21)N)OCP(=O)([O-])OCCCOCCCCCCCCCCCCCCCC(F)(F)F.[NH4+]
InChI	InChI=1S/C28H49F3N5O5P.H3N/c1-24(20-36-22-35-25-26(32)33-21-34-27(25)36)40-23-42(37,38)41-19-15-18-39-17-14-12-10-8-6-4-2-3-5-7-9-11-13-16-28(29,30)31;/h21-22,24H,2-20,23H2,1H3,(H,37,38)(H2,32,33,34);1H3/t24-;/m1./s1
InChIKey	MAVYHINXUMVIRW-GJFSDDNBSA-N
Purity	≥98% (HPLC)
Solubility	In vitro: 10 mM in DMSO
Appearance	Solid powder
Storage	Store at -20°C
Target	HIV