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Tilorone Dihydrochloride

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Chemistry

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Also known as: 27591-69-1, Tilorone hydrochloride, Tilorone 2hcl, Tilorone hcl, Tilorone (dihydrochloride), Deae-f

Molecular Formula

C₂₅H₃₆Cl₂N₂O₃

Molecular Weight

483.5 g/mol

InChI Key

BSVYJQAWONIOOU-UHFFFAOYSA-N

FDA UNII

BJ507J4LKY

An antiviral agent used as its hydrochloride. It is the first recognized synthetic, low-molecular-weight compound that is an orally active interferon inducer, and is also reported to have antineoplastic and anti-inflammatory actions.

1 2D Structure

Tilorone Dihydrochloride

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2,7-bis[2-(diethylamino)ethoxy]fluoren-9-one;dihydrochloride

2.1.2 InChI

InChI=1S/C25H34N2O3.2ClH/c1-5-26(6-2)13-15-29-19-9-11-21-22-12-10-20(30-16-14-27(7-3)8-4)18-24(22)25(28)23(21)17-19;;/h9-12,17-18H,5-8,13-16H2,1-4H3;2*1H

2.1.3 InChI Key

BSVYJQAWONIOOU-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCN(CC)CCOC1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)OCCN(CC)CC.Cl.Cl

2.2 Other Identifiers

2.2.1 UNII

BJ507J4LKY

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Amiksin

2. Amixin

3. Amyxin

4. Bis Deae Fluorenone

5. Bis-deae-fluorenone

6. Hydrochloride, Tilorone

7. Tilorone

8. Tilorone Hydrochloride

2.3.2 Depositor-Supplied Synonyms

1. 27591-69-1

2. Tilorone Hydrochloride

3. Tilorone 2hcl

4. Tilorone Hcl

5. Tilorone (dihydrochloride)

6. Deae-f

7. Tilorone Hydrochloride [usan]

8. Nsc-143969

9. 2,7-bis[2-(diethylamino)ethoxy]-9-fluorenone Dihydrochloride

10. Bj507j4lky

11. Rmi 10008da

12. 2,7-bis(2-(diethylamino)ethoxy)fluoren-9-one Dihydrochloride

13. 9h-fluoren-9-one, 2,7-bis(2-(diethylamino)ethoxy)-, Dihydrochloride

14. 9h-fluoren-9-one, 2,7-bis[2-(diethylamino)ethoxy]-, Dihydrochloride

15. Tilorone Hydrochloride (usan)

16. 2,7-bis[2-(diethylamino)ethoxy]fluoren-9-one Dihydrochloride

17. Bis-deae-fluorenone Hydrochloride

18. Unii-bj507j4lky

19. Lavomax

20. Amixin

21. 2,7-bis(2-(diethylamino)ethoxy)-9h-fluoren-9-one Dihydrochloride

22. 2,7-bis[2-(diethylamino)ethoxy]-9h-fluoren-9-one Dihydrochloride

23. Tilorone Dihcl

24. 2,7-bis(2-diethylaminoethoxy)fluoren-9-one Dihydrochloride

25. Tiloronedihydrochloride

26. Schembl146373

27. Tilorone Dihydrochloride, 95%

28. Chembl539581

29. Chebi:147356

30. Act08564

31. Amy10986

32. Bcp18046

33. Ex-a5740

34. Hy-b1080

35. Mfcd00134071

36. S5020

37. Tilorone Dihydrochloride [mi]

38. Akos005145903

39. Fluoren-9-one, 2,7-bis(2-(diethylamino)ethoxy)-, Dihydrochloride

40. Tilorone Hydrochloride [mart.]

41. Ccg-269573

42. Cs-4636

43. Ks-5182

44. Tilorone Hydrochloride [who-dd]

45. Ft-0656019

46. T2836

47. D06149

48. 591t691

49. J-016822

50. J-524971

51. Q27274704

52. 2,7-bis[2-(diethylamino)ethoxy]fluoren-9-one;dihydrochloride

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₂₅H₃₆Cl₂N₂O₃
Molecular Weight	483.5 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	12
Exact Mass	482.2102984 g/mol
Monoisotopic Mass	482.2102984 g/mol
Topological Polar Surface Area	42 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	477
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	3

4 Pharmacology and Biochemistry

4.1 MeSH Pharmacological Classification

Anti-Inflammatory Agents

Substances that reduce or suppress INFLAMMATION. (See all compounds classified as Anti-Inflammatory 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.)

Antineoplastic Agents

Substances that inhibit or prevent the proliferation of NEOPLASMS. (See all compounds classified as Antineoplastic Agents.)

Interferon Inducers

Agents that promote the production and release of interferons. They include mitogens, lipopolysaccharides, and the synthetic polymers Poly A-U and Poly I-C. Viruses, bacteria, and protozoa have been also known to induce interferons. (See all compounds classified as Interferon Inducers.)

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