Bis{[(isopropoxycarbonyl)oxy]methyl} {[(1-{6-[(isopropoxycarbonyl)amino]-9H-purin-9-yl}-2-propanyl)oxy]methyl}phosphonate | CAS No. 1244022-54-5

Bis{[(isopropoxycarbonyl)oxy]methyl} {[(1-{6-[(isopropoxycarbonyl)amino]-9H-purin-9-yl}-2-propanyl)oxy]methyl}phosphonate

Basic Information

CAS Number

1244022-54-5

Molecular Formula

C23H36N5O12P

Molecular Weight

605.54 g/mol

AD

Basic Physical Properties

CC(OC(=O)OCOP(=O)(COC(Cn1cnc2c1ncnc2NC(=O)OC(C)C)C)OCOC(=O)OC(C)C)C

InChI

InChI=1S/C23H36N5O12P/c1-14(2)38-21(29)27-19-18-20(25-9-24-19)28(10-26-18)8-17(7)35-13-41(32,36-11-33-22(30)39-15(3)4)37-12-34-23(31)40-16(5)6/h9-10,14-17H,8,11-13H2,1-7H3,(H,24,25,27,29)

InChIKey

OIVGIZKCGVNNKM-UHFFFAOYSA-N

LogP

4.410300000000004

Topological Polar Surface Area

197.74999999999997 Ų

Hydrogen Bond Donor/Acceptor

1 / 17

Synonyms & References

English

  • Tenofovir Disoproxil Isopropoxycarbonyl
  • propan-2-yl [[(2R)-1-[6-(propan-2-yloxycarbonylamino)purin-9-yl]propan-2-yl]oxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl carbonate
  • Tenofovir Disoproxil
  • isopropyl (R)-(9-(2-((bis(((isopropoxycarbonyl)oxy)methoxy)phosphoryl)methoxy)propyl)-9H-purin-6-yl)carbamate

MDL Number

MFCD23701767

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