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CAS 911208-73-6 manufacturers and suppliers on PharmaCompass

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CAS 911208-73-6
Also known as: 911208-73-6, Hdp-tenofovir, Cmx157, Cmx-157, 3-(hexadecyloxy)propyl hydrogen ((((r)-1-(6-amino-9h-purin-9-yl)propan-2-yl)oxy)methyl)phosphonate, Cmx 157
Molecular Formula
C28H52N5O5P
Molecular Weight
569.7  g/mol
InChI Key
SCTJKHUUZLXJIP-RUZDIDTESA-N
FDA UNII
K7J545MEMA

Tenofovir exalidex is under investigation in clinical trial NCT01080820 (A Safety, Tolerability and Pharmacokinetic Study of a Single Dose of CMX157 in Healthy Volunteers).
1 2D Structure

CAS 911208-73-6

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(3-hexadecoxypropoxy)phosphinic acid
2.1.2 InChI
InChI=1S/C28H52N5O5P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-36-19-17-20-38-39(34,35)24-37-25(2)21-33-23-32-26-27(29)30-22-31-28(26)33/h22-23,25H,3-21,24H2,1-2H3,(H,34,35)(H2,29,30,31)/t25-/m1/s1
2.1.3 InChI Key
SCTJKHUUZLXJIP-RUZDIDTESA-N
2.1.4 Canonical SMILES
CCCCCCCCCCCCCCCCOCCCOP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)O
2.1.5 Isomeric SMILES
CCCCCCCCCCCCCCCCOCCCOP(=O)(CO[C@H](C)CN1C=NC2=C(N=CN=C21)N)O
2.2 Other Identifiers
2.2.1 UNII
K7J545MEMA
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Cmx 157

2. Cmx-157

3. Cmx157

4. Hdp-tenofovir

5. Hexadecyloxypropyl 9-(2-(phosphonomethoxy)propyl)adenine

2.3.2 Depositor-Supplied Synonyms

1. 911208-73-6

2. Hdp-tenofovir

3. Cmx157

4. Cmx-157

5. 3-(hexadecyloxy)propyl Hydrogen ((((r)-1-(6-amino-9h-purin-9-yl)propan-2-yl)oxy)methyl)phosphonate

6. Cmx 157

7. K7j545mema

8. 9-r-(2-(phosphonomethoxy)propyl)adenine

9. Phosphonic Acid, (((1r)-2-(6-amino-9h-purin-9-yl)-1-methylethoxy)methyl)-, Mono(3-(hexadecyloxy)propyl) Ester

10. Hexadecyloxypropyl Tenofovir

11. Unii-k7j545mema

12. Phosphonic Acid, [[(1r)-2-(6-amino-9h-purin-9-yl)-1-methylethoxy]methyl]-, Mono[3-(hexadecyloxy)propyl] Ester

13. Hdp-pmpa

14. Hdp-(r)-pmpa

15. Tenofovir Exalidex(cmx157)

16. Chembl515564

17. Schembl2299893

18. Tenofovir Exalidex [inn]

19. Bdbm77092

20. Tenofovir Exalidex [who-dd]

21. Hexadecyloxypropyl Ester Of Tenofovir

22. Zinc42875215

23. Db14925

24. Hy-109014

25. Cs-0030512

26. J3.616.616i

27. Q27282054

28. Hexadecyloxypropyl 9-(2-(phosphonomethoxy)propyl)adenine

29. [(1r)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-(3-hexadecoxypropoxy)phosphinic Acid

30. [(2r)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(3-hexadecoxypropoxy)phosphinic Acid

31. 3-(hexadecyloxy)propyl Hydrogen ((((2r)-1-(6-amino-9h-purin-9-yl)propan-2-yl)oxy)methyl)phosphonate

32. 3-(hexadecyloxy)propylhydrogen((((r)-1-(6-amino-9h-purin-9-yl)propan-2-yl)oxy)methyl)phosphonate

33. Phosphonic Acid, P-(((1r)-2-(6-amino-9h-purin-9-yl)-1-methylethoxy)methyl)-, Mono(3(hexadecyloxy)propyl) Ester

34. Phosphonic Acid, P-(((1r)-2-(6-amino-9h-purin-9-yl)-1-methylethoxy)methyl)-, Mono(3-(hexadecyloxy)propyl) Ester

2.4 Create Date
2007-12-26
3 Chemical and Physical Properties
Molecular Weight 569.7 g/mol
Molecular Formula C28H52N5O5P
XLogP36.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count25
Exact Mass569.37060677 g/mol
Monoisotopic Mass569.37060677 g/mol
Topological Polar Surface Area135 Ų
Heavy Atom Count39
Formal Charge0
Complexity650
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Anti-HIV Agents

Agents used to treat AIDS and/or stop the spread of the HIV infection. These do not include drugs used to treat symptoms or opportunistic infections associated with AIDS. (See all compounds classified as Anti-HIV Agents.)


Antiviral Agents

Agents used in the prophylaxis or therapy of VIRUS DISEASES. Some of the ways they may act include preventing viral replication by inhibiting viral DNA polymerase; binding to specific cell-surface receptors and inhibiting viral penetration or uncoating; inhibiting viral protein synthesis; or blocking late stages of virus assembly. (See all compounds classified as Antiviral Agents.)


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