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Chemistry

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Also known as: Clopamide, Chlosudimeprimylum, Mls000551289, Smr000145215, Chlosudimeprimyl, Adurix; aquex; brinaldix; chlosudimeprimyl;clopamidum; dt 327

Molecular Formula

C₁₄H₂₀ClN₃O₃S

Molecular Weight

345.8 g/mol

InChI Key

LBXHRAWDUMTPSE-UHFFFAOYSA-N

A sulfamoylbenzamide piperidine. It is considered a thiazide-like diuretic.

1 2D Structure

Clopamide

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-chloro-N-(2,6-dimethylpiperidin-1-yl)-3-sulfamoylbenzamide

2.1.2 InChI

InChI=1S/C14H20ClN3O3S/c1-9-4-3-5-10(2)18(9)17-14(19)11-6-7-12(15)13(8-11)22(16,20)21/h6-10H,3-5H2,1-2H3,(H,17,19)(H2,16,20,21)

2.1.3 InChI Key

LBXHRAWDUMTPSE-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1CCCC(N1NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N)C

2.2 Synonyms

2.2.1 MeSH Synonyms

1. Brinaldix

2. Brinedine

3. Clopamide

2.2.2 Depositor-Supplied Synonyms

1. Clopamide

2. Chlosudimeprimylum

3. Mls000551289

4. Smr000145215

5. Chlosudimeprimyl

6. Adurix; Aquex; Brinaldix; Chlosudimeprimyl;clopamidum; Dt 327

7. Dt-327

8. 4-chloro-n-(2,6-dimethyl-piperidin-1-yl)-3-sulfamoyl-benzamide

9. Chlorsudimeprimyl

10. Dt 327

11. Ncgc00016527-01

12. Cas-636-54-4

13. Spectrum_001568

14. Opera_id_864

15. Prestwick0_000354

16. Prestwick1_000354

17. Prestwick2_000354

18. Spectrum2_001595

19. Spectrum3_001891

20. Spectrum4_000207

21. Spectrum5_001563

22. Dsstox_cid_2847

23. Dsstox_rid_76757

24. Dsstox_gsid_22847

25. Oprea1_353822

26. Bspbio_003422

27. Kbiogr_000813

28. Kbioss_002048

29. Mls001201776

30. Mls006010787

31. Divk1c_000946

32. Schembl124598

33. Spectrum1503919

34. Spbio_001590

35. Spbio_002368

36. Chembl1361347

37. Dtxsid1022847

38. Chebi:95210

39. Hms502p08

40. Kbio1_000946

41. Kbio2_002048

42. Kbio2_004616

43. Kbio2_007184

44. Kbio3_002925

45. Ninds_000946

46. 4-chloro-n-(2,6-dimethyl-1-piperidinyl)-3-sulfamoylbenzamide

47. Hms1569g09

48. Hms2093k21

49. Hms2233p13

50. Hms3371c11

51. Hms3374m01

52. Tox21_110475

53. Bdbm50237613

54. Ccg-39373

55. Akos024374908

56. Idi1_000946

57. Ncgc00016527-03

58. Ncgc00018272-02

59. Ncgc00018272-03

60. Ncgc00096000-01

61. Ncgc00096000-02

62. Ls-14327

63. Sbi-0051860.p002

64. Db-054517

65. Ft-0603202

66. Sw196897-2

67. Sr-01000675440

68. Q5135114

69. Sr-01000675440-2

70. Brd-a85651701-001-03-1

71. 4-chloro-n-(cis-2,6-dimethylpiperidino)-3-sulfamoylbenzamide

72. 3-(aminosulfonyl)-4-chloro-n-(2,6-dimethylpiperidin-1-yl)benzamide

73. Benzamide, 4-chloro-n-(2,6-dimethylpiperidino)-3-sulfamoyl-, Cis-

74. 3-(aminosulfonyl)-4-chloro-n-(2,6-dimethyl-1-piperidinyl)benzamide-, Cis-

2.3 Create Date

2005-03-25

3 Chemical and Physical Properties

Molecular Formula	C₁₄H₂₀ClN₃O₃S
Molecular Weight	345.8 g/mol
XLogP3	2.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	345.0913904 g/mol
Monoisotopic Mass	345.0913904 g/mol
Topological Polar Surface Area	101 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	498
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1