Tenofovir disoproxil
[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate
Molecular Identity
Tenofovir disoproxil
[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate
PubChem CID: 5481350
Tenofovir disoproxil is an organic phosphonate that is the disoproxil ester of tenofovir. A prodrug for tenofovir, an HIV-1 reverse transcriptase inhibitor, tenofovir disoproxil is used as the fumaric acid salt in combination therapy for the treatment of HIV infection. It has a role as an antiviral drug, a prodrug and a HIV-1 reverse transcriptase inhibitor. It is functionally related to a tenofovir (anhydrous).
2D Structure
Properties
C19H30N5O10P
Molecular Formula
519.40
Molecular Weight
g/mol
519.1730
Exact Mass
Da
1.6
XLogP
Drug-like (Lipinski: < 5)
185
TPSA
May have limited oral absorption
1
H-Bond Donors
14
H-Bond Acceptors
698
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Tenofovir disoproxil201341-05-1Bis(POC)PMPA(r)-bis(poc)pmpabis-POC-PMPAtenofovir bis(isopropyloxycarbonyloxymethyl) esterF4YU4LON7I9-((R)-2-((Bis(((isopropoxycarbonyl)oxy)methoxy)phosphinyl)methoxy)propyl)adenine2,4,6,8-Tetraoxa-5-phosphanonanedioic acid, 5-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]-, 1,9-bis(1-methylethyl) ester, 5-oxideGS-4331DTXSID5052757CHEBI:63717STRIBILD COMPONENT TENOFOVIR DISOPROXIL2,4,6,8-TETRAOXA-5-PHOSPHANONANEDIOIC ACID, 5-(((1R)-2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY)METHYL)-, 1,9-BIS(1-METHYLETHYL) ESTER, 5-OXIDEbis({[(propan-2-yloxy)carbonyl]oxy}methyl) ({[(2R)-1-(6-amino-9H-purin-9-yl)propan-2-yl]oxy}methyl)phosphonate
Data from PubChem (NCBI)
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