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Lercanidipine HCl

Lercanidipine HCl

Synopsis, Chemistry

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Also known as: 132866-11-6, Lercanidipine hcl, Cardiovasc, Corifeo, Carmen, Lercadip

Molecular Formula

C₃₆H₄₂ClN₃O₆

Molecular Weight

648.2 g/mol

InChI Key

WMFYOYKPJLRMJI-UHFFFAOYSA-N

FDA UNII

OA8TFX68PE

1 2D Structure

Lercanidipine HCl

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

5-O-[1-[3,3-diphenylpropyl(methyl)amino]-2-methylpropan-2-yl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;hydrochloride

2.1.2 InChI

InChI=1S/C36H41N3O6.ClH/c1-24-31(34(40)44-6)33(28-18-13-19-29(22-28)39(42)43)32(25(2)37-24)35(41)45-36(3,4)23-38(5)21-20-30(26-14-9-7-10-15-26)27-16-11-8-12-17-27;/h7-19,22,30,33,37H,20-21,23H2,1-6H3;1H

2.1.3 InChI Key

WMFYOYKPJLRMJI-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC(C)(C)CN(C)CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC.Cl

2.2 Other Identifiers

2.2.1 UNII

OA8TFX68PE

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Lercadip

2. Lercanidipine

3. Lerdip

4. Methyl-1,1-dimethyl-2-(n-(3,3-diphenylpropyl)-n-methylamino)ethyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

5. Rec 15-2375

6. Rec-15-2375

7. Zanidip

2.3.2 Depositor-Supplied Synonyms

1. 132866-11-6

2. Lercanidipine Hcl

3. Cardiovasc

4. Corifeo

5. Carmen

6. Lercadip

7. Lerzam

8. Lercan

9. Rec-15/2375

10. Lercanidipine (hydrochloride)

11. Lercanidipine Hydrochloride Hemihydrate

12. 3-(1-((3,3-diphenylpropyl)(methyl)amino)-2-methylpropan-2-yl) 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Hydrochloride

13. Lercanidipine Hydrochloride [usan]

14. Oa8tfx68pe

15. 100427-27-8

16. 5-o-[1-[3,3-diphenylpropyl(methyl)amino]-2-methylpropan-2-yl] 3-o-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;hydrochloride

17. Lercapin

18. Lercaton

19. Lerkamen

20. Renovia

21. Vasodip

22. Zanicor

23. Zandip

24. Dsstox_cid_26665

25. Dsstox_rid_81807

26. Dsstox_gsid_46665

27. Zanidip

28. (r)-lercanidipine (hydrochloride)

29. (s)-lercanidipine (hydrochloride)

30. Lerdip

31. 2-((3,3-diphenylpropyl)methylamino)-1,1-dimethylethyl Methyl (4rs)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Monohydrochloride

32. 3,5-pyridinedicarboxylic Acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 2-((3,3-diphenylpropyl)methylamino)-1,1-dimethylethyl Methyl Ester, Monohydrochloride

33. 3-(1-((3,3-diphenylpropyl)(methyl)amino)-2-methylpropan-2-yl) 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Hydrochloride(1:x)

34. Cas-132866-11-6

35. Lercanidipinehcl

36. Zanidip (hydrochloride)

37. Ncgc00167492-01

38. Unii-oa8tfx68pe

39. Masnidipine (hydrochloride)

40. R 75

41. Zanedip

42. Cardiovasc (tn)

43. Lcp-lerc

44. Zanidip Hydrochloride

45. Masnidipine Hydrochloride

46. Schembl217099

47. Chembl2106419

48. Dtxsid3046665

49. Chebi:31771

50. Hy-b0612a

51. Lercanidipine-[d3] Hydrochloride

52. Tjn-324

53. Lercanidipine Hydrochloride (1:x)

54. Lercanidipine Hydrochloride- Bio-x

55. Bcp11375

56. Tox21_112493

57. Tox21_500144

58. Mfcd07773089

59. S4597

60. Akos015846519

61. Tox21_112493_1

62. Ac-1420

63. Ccg-221448

64. Ccg-270327

65. Lp00144

66. Lercanidipine Hydrochloride (jan/usan)

67. Lercanidipine Hydrochloride [mi]

68. Lercanidipine Hydrochloride [jan]

69. Ncgc00167492-03

70. Ncgc00260829-01

71. As-13358

72. Bl164618

73. Lercanidipine Hydrochloride [mart.]

74. Db-042142

75. Lercanidipine Hydrochloride [who-dd]

76. Ft-0627794

77. Ft-0631144

78. Ft-0670749

79. Ft-0670750

80. L0282

81. Lercanidipine Hydrochloride, >=98% (hplc)

82. D01849

83. 866l116

84. A806509

85. J-006235

86. J-006236

87. J-521641

88. Q27285537

89. 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic Acid 2-[(3,3-diphenylpropyl)

90. 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic Acid O5-[1-[3,3-diphenylpropyl(methyl)amino]-2-methylpropan-2-yl] Ester O3-methyl Ester Hydrochloride

91. 3,3-diphenylpropyl-[2-[5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carbonyl]oxy-2-methylpropyl]-methylazanium;chloride

92. 3,5-pyridinedicarboxylic Acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 2-(3,3-diphenylpropyl)methylamino)-1,1-dimethylethyl Methyl Ester, Monohydrochloride

93. 3,5-pyridinedicarboxylic Acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 3-[2-[(3,3-diphenylpropyl)methylamino]-1,1-dimethylethyl] 5-methyl Ester, Hydrochloride (1:1)

94. O5-[1-[3,3-diphenylpropyl(methyl)amino]-2-methyl-propan-2-yl] O3-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Hydrochloride

2.4 Create Date

2005-06-24

3 Chemical and Physical Properties

Molecular Formula	C₃₆H₄₂ClN₃O₆
Molecular Weight	648.2 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	13
Exact Mass	647.2762138 g/mol
Monoisotopic Mass	647.2762138 g/mol
Topological Polar Surface Area	114 Å²
Heavy Atom Count	46
Formal Charge	0
Complexity	1090
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

4 Pharmacology and Biochemistry

4.1 MeSH Pharmacological Classification

Antihypertensive Agents

Drugs used in the treatment of acute or chronic vascular HYPERTENSION regardless of pharmacological mechanism. Among the antihypertensive agents are DIURETICS; (especially DIURETICS, THIAZIDE); ADRENERGIC BETA-ANTAGONISTS; ADRENERGIC ALPHA-ANTAGONISTS; ANGIOTENSIN-CONVERTING ENZYME INHIBITORS; CALCIUM CHANNEL BLOCKERS; GANGLIONIC BLOCKERS; and VASODILATOR AGENTS. (See all compounds classified as Antihypertensive Agents.)

Calcium Channel Blockers

A class of drugs that act by selective inhibition of calcium influx through cellular membranes. (See all compounds classified as Calcium Channel Blockers.)