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2D Structure
Also known as: 24678-13-5, Lenperonum, Ahr-2277 [as hydrochloride], 13p4gx22es, 4'-fluoro-4-(4-(p-fluorobenzoyl)piperidino)butyrophenone, Ahr 2277
Molecular Formula
C22H23F2NO2
Molecular Weight
371.4  g/mol
InChI Key
WCIBOXFOUGQLFC-UHFFFAOYSA-N
FDA UNII
13P4GX22ES

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-[4-(4-fluorobenzoyl)piperidin-1-yl]-1-(4-fluorophenyl)butan-1-one
2.1.2 InChI
InChI=1S/C22H23F2NO2/c23-19-7-3-16(4-8-19)21(26)2-1-13-25-14-11-18(12-15-25)22(27)17-5-9-20(24)10-6-17/h3-10,18H,1-2,11-15H2
2.1.3 InChI Key
WCIBOXFOUGQLFC-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCCC(=O)C3=CC=C(C=C3)F
2.2 Other Identifiers
2.2.1 UNII
13P4GX22ES
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 4'-fluoro-4-(4-(p-fluorobenozyl)piperidino)butyrophenone

2. Ahr 2277

3. Ahr-2277

4. Lenperone Hydrochloride

2.3.2 Depositor-Supplied Synonyms

1. 24678-13-5

2. Lenperonum

3. Ahr-2277 [as Hydrochloride]

4. 13p4gx22es

5. 4'-fluoro-4-(4-(p-fluorobenzoyl)piperidino)butyrophenone

6. Ahr 2277

7. Chembl316004

8. 1-butanone, 4-(4-(4-fluorobenzoyl)-1-piperidinyl)-1-(4-fluorophenyl)-

9. 4-(4-(4-fluorobenzoyl)-1-piperidinyl)-1-(4-fluorophenyl)-1-butanone

10. Lenperone (usan)

11. Ncgc00160383-01

12. Lenperone [usan]

13. 4-[4-(4-fluoro-benzoyl)-piperidin-1-yl]-1-(4-fluoro-phenyl)-butan-1-one

14. Lenperonum [latin]

15. Lenperona [spanish]

16. Lenperona

17. Lenperone [usan:inn]

18. Lenperonum [inn-latin]

19. 4-(4-(4-fluorobenzoyl)piperidin-1-yl)-1-(4-fluorophenyl)butan-1-one

20. 4-[4-(4-fluorobenzoyl)-1-piperidinyl]-1-(4-fluorophenyl)-1-butanone

21. 4-[4-(4-fluorobenzoyl)piperidin-1-yl]-1-(4-fluorophenyl)butan-1-one

22. Lenperona [inn-spanish]

23. 1-butanone, 4-[4-(4-fluorobenzoyl)-1-piperidinyl]-1-(4-fluorophenyl)-

24. Ahr2277

25. Nsc303301

26. Einecs 246-399-7

27. Brn 1554429

28. Unii-13p4gx22es

29. Lenperone [inn]

30. Lenperone [who-dd]

31. Dsstox_cid_26120

32. Dsstox_rid_81356

33. Dsstox_gsid_46120

34. 5-21-08-00146 (beilstein Handbook Reference)

35. Mls001205808

36. Schembl121686

37. Ahr-2277 Free Base

38. Dtxsid7046120

39. Hms2834c09

40. Zinc537887

41. Tox21 111775

42. Tox21_111775

43. Bdbm50004320

44. Ncgc00160383-02

45. Lenperone Hydrochloride (*hydrochloride*)

46. Smr000504164

47. Cas-24678-13-5

48. Ft-0670760

49. D02668

50. Q6523202

51. Butyrophenone, 4'-fluoro-4-[4-(p-fluorobenzoyl)piperidino]-

52. 1-(4-fluorophenyl)-4-(4-(4-fluorobenzoyl)piperidino)-1-butanone

53. 4-[4-(4-fluorobenzoyl)-1-piperidyl]-1-(4-fluorophenyl)butan-1-one

54. 1-(4-fluorophenyl)-4-{4-[(4-fluorophenyl)carbonyl]piperidin-1-yl}butan-1-one

55. 1-butanone, {4-[4-(4-fluorobenzoyl)-1-piperidinyl]-1-(4-fluorophenyl)-,} Hydrochloride

56. Butyrophenone, {4'-fluoro-4-[4-(p-fluorobenzoyl)piperidino]-,} Hydrochloride

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 371.4 g/mol
Molecular Formula C22H23F2NO2
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass371.16968530 g/mol
Monoisotopic Mass371.16968530 g/mol
Topological Polar Surface Area37.4 Ų
Heavy Atom Count27
Formal Charge0
Complexity489
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1