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Also known as: 26328-04-1, Vasodistal, Brendil, Cinepazide maleate [jan], Cinepazide (maleate), 28044-44-2

Molecular Formula

C₂₆H₃₅N₃O₉

Molecular Weight

533.6 g/mol

InChI Key

XSTJTOKYCAJVMJ-GVTSEVKNSA-N

FDA UNII

Y35B3VA60V

1 2D Structure

Cinepazide Maleate

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(Z)-but-2-enedioic acid;(E)-1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one

2.1.2 InChI

InChI=1S/C22H31N3O5.C4H4O4/c1-28-18-14-17(15-19(29-2)22(18)30-3)6-7-20(26)25-12-10-23(11-13-25)16-21(27)24-8-4-5-9-24;5-3(6)1-2-4(7)8/h6-7,14-15H,4-5,8-13,16H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b7-6+;2-1-

2.1.3 InChI Key

XSTJTOKYCAJVMJ-GVTSEVKNSA-N

2.1.4 Canonical SMILES

COC1=CC(=CC(=C1OC)OC)C=CC(=O)N2CCN(CC2)CC(=O)N3CCCC3.C(=CC(=O)O)C(=O)O

2.1.5 Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)N2CCN(CC2)CC(=O)N3CCCC3.C(=C\C(=O)O)\C(=O)O

2.2 Other Identifiers

2.2.1 UNII

Y35B3VA60V

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 1-((1-pyrrolidinylcarbonyl)methyl)-4-(3,4,5-trimethoxycinnamoyl)piperazine

2. 1-((1-pyrrolidynylcarbonyl)methyl)-4-(3,4,5-trimethoxycinnamoyl)piperazine Maleate

3. 67350-md

4. Cinepazide

5. Md-67350 Free Base

6. Vasodistal

2.3.2 Depositor-Supplied Synonyms

1. 26328-04-1

2. Vasodistal

3. Brendil

4. Cinepazide Maleate [jan]

5. Cinepazide (maleate)

6. 28044-44-2

7. Md 67350

8. Y35b3va60v

9. 26328-04-1 (maleate)

10. Nsc-291562

11. Md-67350

12. Cinepazide Maleate (jan)

13. 1-((1-pyrrolidinylcarbonyl)methyl)-4-(3,4,5-trimethoxycinnamoyl)piperazine Maleate

14. 1-((pyrrolidin-1-ylcarbonyl)methyl)-4-(3,4,5-trimethoxycinnamoyl)piperazine Maleate

15. 1-[(1-pyrrolidinylcarbonyl)methyl]-4-(3,4,5-trimethoxycinnamoyl)piperazine Maleate

16. 1-[(pyrrolidin-1-ylcarbonyl)methyl]-4-(3,4,5-trimethoxycinnamoyl)piperazine Maleate

17. 1-(2-oxo-2-(1-pyrrolidinyl)ethyl)-4-(1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)piperazine (z)-2-butenedioate (1:1)

18. Maleate De Cinepazide

19. Mls003115636

20. Unii-y35b3va60v

21. Maleate De Cinepazide [french]

22. 2-propen-1-one, 1-(4-(2-oxo-2-(1-pyrrolidinyl)ethyl)-1-piperazinyl)-3-(3,4,5-trimethoxyphenyl)-, (2z)-2-butenedioate (1:1)

23. 2-propen-1-one, 1-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]-3-(3,4,5-trimethoxyphenyl)-, (2z)-2-butenedioate (1:1)

24. Einecs 247-613-1

25. Einecs 248-795-5

26. Nsc 291562

27. (e)-1-(4-(2-oxo-2-(pyrrolidin-1-yl)ethyl)piperazin-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Maleate

28. Schembl1062368

29. Cinepazide Maleate [mi]

30. Chembl4303265

31. Piperazine, 1-[(1-pyrrolidinylcarbonyl)methyl]-4-(3,4,5-trimethoxycinnamoyl)-, Maleate

32. Hms3885g05

33. Cinepazide Maleate [mart.]

34. (z)-but-2-enedioic Acid;(e)-1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one

35. Cinepazide Maleate [who-dd]

36. Mfcd01320526

37. Nsc291562

38. S3045

39. Cinepazide Maleate, >=98% (hplc)

40. Akos015950975

41. Ccg-269931

42. 1-(4-((3',4',5'-trimethoxycinnamoyl)-1-piperazinyl)acetyl)pyrrolidine Maleate

43. 4-(3,4,5-trimethoxycinnamoyl)-1-(1-pyrrolidinyl)carbonylmethylpiperazine Maleate

44. As-17788

45. Hy-66010

46. Sw220164-1

47. Piperazine,4,5-trimethoxycinnamoyl)-, Maleate

48. D01944

49. 328c041

50. A818386

51. Q27294204

52. Piperazine,4,5-trimethoxyphenyl)-2-propenyl]-, (z)-2-butenedioate (1:1)

53. (z)-1-(4-((3',4',5'-trimethoxycinnamoyl)-1-piperazinyl)acetyl)pyrrolidinemaleate

54. Piperazine, 1-((1-pyrrolidinylcarbonyl)methyl)-4-(3',4',5'-trimethoxycinnamoyl)-, Maleate

55. (z)-but-2-enedioate; (e)-1-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one;cinepazide Maleate

56. 1-(2-oxo-2-pyrrolidin-1-ylethyl)-4-(3-(3,4,5-trimethoxyphenyl)acryloyl)piperazine Monomaleate

57. 1-(4-(2-oxo-2-(pyrrolidin-1-yl)ethyl)piperazin-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Maleate

58. 1202583-45-6

59. Piperazine, 1-(2-oxo-2-(1-pyrrolidinyl)ethyl)-4-(1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)-, (z)-2-butenedioate (1:1)

2.4 Create Date

2005-10-11

3 Chemical and Physical Properties

Molecular Formula	C₂₆H₃₅N₃O₉
Molecular Weight	533.6 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	9
Exact Mass	533.23732970 g/mol
Monoisotopic Mass	533.23732970 g/mol
Topological Polar Surface Area	146 Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	705
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

4 Pharmacology and Biochemistry

4.1 MeSH Pharmacological Classification

Vasodilator Agents

Drugs used to cause dilation of the blood vessels. (See all compounds classified as Vasodilator Agents.)

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