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CHEMISTRY
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ACTIVE PHARMA INGREDIENTS

6 API Suppliers, 2 USDMF, 5 CEP/COS

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Chemistry

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Also known as: Buflomedil hcl, 35543-24-9, Fonzylane, Loftyl, Buflomedil (hydrochloride), 4-(1-pyrrolidinyl)-1-(2,4,6-trimethoxyphenyl)-1-butanone hydrochloride

Molecular Formula

C₁₇H₂₆ClNO₄

Molecular Weight

343.8 g/mol

InChI Key

ZDPACSAHMZADFZ-UHFFFAOYSA-N

FDA UNII

3J944AFS8S

1 2D Structure

Buflomedil

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-pyrrolidin-1-yl-1-(2,4,6-trimethoxyphenyl)butan-1-one;hydrochloride

2.1.2 InChI

InChI=1S/C17H25NO4.ClH/c1-20-13-11-15(21-2)17(16(12-13)22-3)14(19)7-6-10-18-8-4-5-9-18;/h11-12H,4-10H2,1-3H3;1H

2.1.3 InChI Key

ZDPACSAHMZADFZ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

COC1=CC(=C(C(=C1)OC)C(=O)CCCN2CCCC2)OC.Cl

2.2 Other Identifiers

2.2.1 UNII

3J944AFS8S

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 2,4,6-trimethoxyphenyl-3-pyrrolidine Propyl Ketone

2. Blufomedil

3. Bufedil

4. Buflo 1a Pharma

5. Buflo Abz

6. Buflo-pos

7. Buflo-puren

8. Buflohexal

9. Buflomedil

10. Buflomedil Heumann

11. Buflomedil Lindo

12. Buflomedil Pyridoxal Phosphate

13. Buflomedil Stada

14. Buflomedil Von Ct

15. Buflomedil-ratiopharm

16. Bufomedil

17. Fonzylane

18. Ll 1656

19. Lofton

20. Loftyl

21. Sinoxis

2.3.2 Depositor-Supplied Synonyms

1. Buflomedil Hcl

2. 35543-24-9

3. Fonzylane

4. Loftyl

5. Buflomedil (hydrochloride)

6. 4-(1-pyrrolidinyl)-1-(2,4,6-trimethoxyphenyl)-1-butanone Hydrochloride

7. Mls000028735

8. 3j944afs8s

9. Bufedil

10. Nsc-759291

11. Irrodan

12. Smr000058803

13. Lofton

14. 4-(pyrrolidin-1-yl)-1-(2,4,6-trimethoxyphenyl)butan-1-one Hydrochloride

15. Dsstox_cid_26977

16. Dsstox_rid_82032

17. Dsstox_gsid_46977

18. Buflocit

19. Buflan

20. Irrodan R

21. Buflomedil Hydrochloride [jan]

22. Sr-01000721839

23. Ncgc00016831-01

24. Cas-35543-24-9

25. Ll 1656

26. Unii-3j944afs8s

27. 4-pyrrolidin-1-yl-1-(2,4,6-trimethoxyphenyl)butan-1-one;hydrochloride

28. Prestwick_782

29. Einecs 252-611-9

30. Mfcd00078965

31. Opera_id_262

32. Bucladesine (calcium Salt)

33. A-48257

34. Buflomedil Hydrochloride,(s)

35. Mls001148174

36. Mls001401458

37. Mls002222262

38. Mls006010627

39. Schembl211907

40. Chembl1715107

41. Dtxsid6046977

42. Buflomedil For Peak Identification

43. Hms1569e14

44. Pharmakon1600-01505992

45. Bcp13305

46. Hy-b0484

47. Tox21_110636

48. Tox21_301435

49. 4-(1-pyrrolidyl)-1-(2,4,6-trimethoxyphenyl)-1-butanone Hydrochloride

50. Buflomedil Hydrochloride [mi]

51. Nsc759291

52. S2607

53. Akos015962015

54. Chlorhydrate De (trimethoxy-2-4-6) Phenyl-(pyrrolidine-3) Propylacetone

55. Tox21_110636_1

56. Ab03021

57. Ccg-100878

58. Ds-9078

59. Nc00128

60. Nsc 759291

61. Buflomedil Hydrochloride [mart.]

62. Chlorhydrate De (trimethoxy-2-4-6) Phenyl-(pyrrolidine-3) Propylacetone [french]

63. Buflomedil Hydrochloride [who-dd]

64. Ncgc00016831-06

65. Ncgc00180961-01

66. Ncgc00256242-01

67. Ac-15509

68. B3647

69. Buflomedil Hydrochloride, Analytical Standard

70. Ft-0623281

71. Sw196920-4

72. Buflomedil Hydrochloride [ep Monograph]

73. 543b249

74. Q-200766

75. Sr-01000721839-4

76. Sr-01000721839-5

77. Q27257293

78. Buflomedil Hydrochloride 1.0 Mg/ml In Methanol (as Free Base)

79. Buflomedil Hydrochloride, European Pharmacopoeia (ep) Reference Standard

80. 1-butanone, 4-(1-pyrrolidinyl)-1-(2,4,6-trimethoxyphenyl)-, Hydrochloride

81. Buflomedil For Peak Identification, European Pharmacopoeia (ep) Reference Standard

2.4 Create Date

2006-04-14

3 Chemical and Physical Properties

Molecular Formula	C₁₇H₂₆ClNO₄
Molecular Weight	343.8 g/mol
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	8
Exact Mass	343.1550360 g/mol
Monoisotopic Mass	343.1550360 g/mol
Topological Polar Surface Area	48 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	330
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	2