Please Wait
Applying Filters...
Menu
Xls
2D Structure
Also known as: Iminostilbene, 5h-dibenzo[b,f]azepine, 5h-dibenz[b,f]azepine, Dibenz(b,f)azepine, 5h-dibenz(b,f)azepine, Dibenz[b,f]azepine
Molecular Formula
C14H11N
Molecular Weight
193.24  g/mol
InChI Key
LCGTWRLJTMHIQZ-UHFFFAOYSA-N
FDA UNII
J411KQJ8C2

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
11H-benzo[b][1]benzazepine
2.1.2 InChI
InChI=1S/C14H11N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-10,15H
2.1.3 InChI Key
LCGTWRLJTMHIQZ-UHFFFAOYSA-N
2.2 Other Identifiers
2.2.1 UNII
J411KQJ8C2
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Gsi Xx

2. Iminostilbene

3. Iminostilbene, 10-(13)c-labeled

2.3.2 Depositor-Supplied Synonyms

1. Iminostilbene

2. 5h-dibenzo[b,f]azepine

3. 5h-dibenz[b,f]azepine

4. Dibenz(b,f)azepine

5. 5h-dibenz(b,f)azepine

6. Dibenz[b,f]azepine

7. 5h-dibenzo(b,f)azepine

8. O,o'-iminostilbene

9. 5h-dibenz[b,f]azepin

10. 5h-dibenzazepine

11. Einecs 205-970-0

12. Unii-j411kqj8c2

13. J411kqj8c2

14. Chebi:47802

15. Nsc-123458

16. Dtxsid90871625

17. Ec 205-970-0

18. Carbamazepine Impurity D [ip]

19. Rp-9989

20. 5h-dibenz(b,f)azepin

21. Carbamazepine Impurity D [ep Impurity]

22. Oxcarbazepine Impurity E [ep Impurity]

23. Carbamazepine Impurity D (ip)

24. Carbamazepine Impurity D (ep Impurity)

25. Oxcarbazepine Impurity E (ep Impurity)

26. Gsi Xx

27. Dtxcid4020458

28. Dtxcid60819276

29. Iminostilbene, 10-(13)c-labeled

30. (2s)-2-((2-(3,5-difluorophenyl)acetyl)amino)-n-((7s)-5-methyl-6-oxo-7h-benzo(d)(1)benzazepin-7-yl)propanamide

31. Dtxsid6040458

32. Lcgtwrljtmhiqz-uhfffaoysa-n

33. 256-96-2

34. 2,2'-iminostilbene

35. 2,3,6,7-dibenzazepine

36. Stilbene, 2,2'-imino-

37. 11h-benzo[b][1]benzazepine

38. Iminostilbene-d2

39. 5-azadibenzo(a,e)cycloheptatriene

40. Mfcd00005071

41. Nsc 123458

42. Mls000737549

43. 5-azadibenzo[a,e]cycloheptatriene

44. 5h-dibenzo[b,f]azepine (iminostilbene)

45. 5h-dibenzo[b,f]azepine;oxcarbazepine Ep Impurity E;

46. Stilbene,2'-imino-

47. 2,6,7-dibenzazepine

48. Iminostilbene (standard)

49. Oprea1_371695

50. Schembl75288

51. (z)-5h-dibenzo[b,f]azepine

52. Chembl243596

53. 5h-dibenz[b,f]azepine, 97%

54. Schembl10434951

55. Hy-n7064r

56. Hms1664f10

57. Hms2769i10

58. Hms3886o07

59. Hy-n7064

60. Str04241

61. Nsc123458

62. S4973

63. Akos015894918

64. Ccg-266525

65. Cs-w015765

66. Fi24557

67. Ncgc00246953-01

68. Ac-11074

69. Smr000065475

70. Db-046759

71. I0414

72. Ns00000328

73. Ns00124786

74. En300-176476

75. F15408

76. Q61388

77. 5h-dibenz[b,f]azepine, Purum, >=97.0% (nt)

78. Z56754946

79. 2-azatricyclo[9.4.0.0,3,8]pentadeca-1(15),3,5,7,9,11,13-heptaene

80. 5h-dibenz[b,f]azepine;2,2'-iminostilbene;5-azadibenzo[a,e]cycloheptatriene

81. 2-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaene

82. Iminostilbene; P-toluenesulfonic Acid Sodium Salt; Toluene-4-sulfonic Acid Sodium Salt; 4-methylbenzenesulfonic Acid Sodium Salt

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 193.24 g/mol
Molecular Formula C14H11N
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area12
Heavy Atom Count15
Formal Charge0
Complexity222
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Enzyme Inhibitors

Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)


Gamma Secretase Inhibitors and Modulators

Agents that suppress GAMMA-SECRETASE by inhibiting or modulating its activities. Targeted enzymatic activities include its involvement in accumulation of toxic AMYLOID BETA-PEPTIDES (e.g., Aβ42) in ALZHEIMER DISEASE and activation of NOTCH RECEPTOR mediated SIGNAL PATHWAYS in certain cancer types. (See all compounds classified as Gamma Secretase Inhibitors and Modulators.)


4.2 ATC Code

N03AF01

S66 | EAWAGTPS | Parent-Transformation Product Pairs from Eawag | DOI:10.5281/zenodo.3754448