Tenofovir prodrug
[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(pentan-3-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl pentan-3-yl carbonate
Also Known As: Tenofovir prodrug|PMPA prodrug|Bis(3-PentylOC)PMPA|2,4,6,8-Tetraoxa-5-phosphanonanedioic acid, 5-((2-(6-amino-9H-purin-9-yl)-1-methylethoxy)methyl)-, bis(1-ethylpropyl) ester, 5-oxide, (R)-|[[(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-(1-ethylpropoxycarbonyloxymethoxy)phosphoryl]oxymethyl 1-ethylpropyl carbonate|[[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(pentan-3-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl pentan-3-yl carbonate|2,4,6,8-Tetraoxa-5-phosphanonanedioic acid, 5-[[2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]-, bis(1-ethylpropyl) ester, 5-oxide, (R)-|Bis[({[(pentan-3-yl)oxy]carbonyl}oxy)methyl] ({[(2R)-1-(6-amino-9H-purin-9-yl)propan-2-yl]oxy}methyl)phosphonate
| Molecular Formula | C23H38N5O10P |
|---|---|
| Molecular Weight | 575.23566 g/mol |
| LogP | 4.596 |
| Topological Polar Surface Area | 185.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 17 |
| Exact Mass | 575.23566 |
| Monoisotopic Mass | 575.23566 |
| Heavy Atoms | 39 |
| Complexity | 1056.4326 |
Chemical Identifiers
| CAS Number | 201341-07-3 |
|---|---|
| SMILES | CCC(CC)OC(=O)OCOP(=O)(CO[C@H](C)CN1C=NC2=C(N=CN=C21)N)OCOC(=O)OC(CC)CC |
Product Overview
Tenofovir prodrug (CAS 201341-07-3), with molecular formula C23H38N5O10P and molecular weight 575.23566 g/mol. IUPAC: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(pentan-3-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl pentan-3-yl carbonate.