CAS 133909-99-6

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2 Intermediates

2 Intermediates

Chemistry

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Also known as: 133909-99-6, Trityl losartan, N-trityllosartan, N2-trityllosartan, N-trityl losartan, (2-butyl-4-chloro-1-((2'-(2-trityl-2h-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-1h-imidazol-5-yl)methanol

Molecular Formula

C₄₁H₃₇ClN₆O

Molecular Weight

665.2 g/mol

InChI Key

QQPGGBNMTNDKEY-UHFFFAOYSA-N

FDA UNII

N0UJG23A3Y

1 2D Structure

CAS 133909-99-6

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[2-butyl-5-chloro-3-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazol-4-yl]methanol

2.1.2 InChI

InChI=1S/C41H37ClN6O/c1-2-3-23-38-43-39(42)37(29-49)47(38)28-30-24-26-31(27-25-30)35-21-13-14-22-36(35)40-44-46-48(45-40)41(32-15-7-4-8-16-32,33-17-9-5-10-18-33)34-19-11-6-12-20-34/h4-22,24-27,49H,2-3,23,28-29H2,1H3

2.1.3 InChI Key

QQPGGBNMTNDKEY-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN(N=N4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)CO)Cl

2.2 Other Identifiers

2.2.1 UNII

N0UJG23A3Y

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 133909-99-6

2. Trityl Losartan

3. N-trityllosartan

4. N2-trityllosartan

5. N-trityl Losartan

6. (2-butyl-4-chloro-1-((2'-(2-trityl-2h-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-1h-imidazol-5-yl)methanol

7. [2-butyl-5-chloro-3-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazol-4-yl]methanol

8. N0ujg23a3y

9. N-trityl Losartan (losartan Impurity H)

10. 1h-imidazole-5-methanol, 2-butyl-4-chloro-1-((2'-(2-(triphenylmethyl)-2h-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-

11. 2-butyl-4-chloro-5-hydroxymethyl-1-((2'-(1h-2-triphenylmethyl-tetrazol-5-yl)biphenyl-4-yl)methyl)imidazole

12. [2-butyl-4-chloro-1-[[2'-[2-(triphenylmethyl)-2h-tetrazol-5-yl]biphenyl-4-yl]methyl]-1h-imidazol-5-yl]methanol

13. Unii-n0ujg23a3y

14. Iosartan

15. Ec 412-420-5

16. Schembl3407499

17. Dtxsid80158417

18. Bcp12002

19. Losartan Potassium Impurity H [ep]

20. Mfcd09028113

21. Akos015895667

22. Zinc150341103

23. Ac-1071

24. 2-butyl-4-chloro-4,5-dihydro-5-hydroxymethyl-1-(2'-(2-triphenylmethyl-1,2,3,4-2h-tetrazol-5-yl)-1,1'-biphenyl-4-methyl)-1h-imidazole

25. 2-n-butyl-4-chloro-1-[(2'-(2-triphenylmethyl-2h-tetrazol-5-yl)-1,1'-biphenyl-4-yl)methyl]-1h-imidazole-5-methanol

26. Ft-0656123

27. 909b996

28. Losartan Potassium Impurity H[ep Impurity]

29. J-006452

30. Q27284359

31. 2-butyl-4-chloro-1-[2'-(2-trityl-2h-tetrazole-5-yl)biphenyl-4-yl-methyl]-1h-imidazole-5-yl-methanol

32. 2-n-butyl-4-chloro-1-[(2'-(2-triphenylmethyl-2h-tetrazol-5-yl) -1,1'-biphenyl-4-yl)methyl]-1h-imidazole-5-methanol

33. 2-n-butyl-4-chloro-1-[(2'-(2-triphenylmethyl-2h-tetrazol-5-yl)-1,1'-biphenyl -4-yl)methyl]-1h-imidazole-5-methanol

34. 2-n-butyl-4-chloro-1-[(2'-(2-triphenylmethyl-2h-tetrazol-5-yl)-1,1'-biphenyl-4-yl)methyl]1h-imidazole-5-methanol

2.4 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₄₁H₃₇ClN₆O
Molecular Weight	665.2 g/mol
XLogP3	9.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	12
Exact Mass	664.2717375 g/mol
Monoisotopic Mass	664.2717375 g/mol
Topological Polar Surface Area	81.6 Å²
Heavy Atom Count	49
Formal Charge	0
Complexity	932
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1