Please Wait
Applying Filters...
Menu
Xls
2D Structure
Also known as: 89419-40-9, Clospipramine, Mosapramine [inn], Mosapramine (hydrochloride), 04uzq7o9sj, Clospipramine (hydrochloride)
Molecular Formula
C28H35ClN4O
Molecular Weight
479.1  g/mol
InChI Key
PXUIZULXJVRBPC-UHFFFAOYSA-N
FDA UNII
04UZQ7O9SJ

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1'-[3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]spiro[1,5,6,7,8,8a-hexahydroimidazo[1,2-a]pyridine-3,4'-piperidine]-2-one
2.1.2 InChI
InChI=1S/C28H35ClN4O/c29-23-12-11-22-10-9-21-6-1-2-7-24(21)32(25(22)20-23)16-5-15-31-18-13-28(14-19-31)27(34)30-26-8-3-4-17-33(26)28/h1-2,6-7,11-12,20,26H,3-5,8-10,13-19H2,(H,30,34)
2.1.3 InChI Key
PXUIZULXJVRBPC-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CCN2C(C1)NC(=O)C23CCN(CC3)CCCN4C5=CC=CC=C5CCC6=C4C=C(C=C6)Cl
2.2 Other Identifiers
2.2.1 UNII
04UZQ7O9SJ
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 3-chloro-5-(3-(2-oxo-1,2,3,5,6,7,8,8a-octahydroimidazo(1,2-a)pyridine-3-spiro-4'-piperidino)propyl)-10,11-dihydro-5h-dibenz(b,f)azepine

2. Y 516

3. Y-516

2.3.2 Depositor-Supplied Synonyms

1. 89419-40-9

2. Clospipramine

3. Mosapramine [inn]

4. Mosapramine (hydrochloride)

5. 04uzq7o9sj

6. Clospipramine (hydrochloride)

7. Mosapramine (inn)

8. 1'-[3-(3-chloro-10,11-dihydro-5h-dibenzo[b,f]azepin-5-yl)propyl]hexahydro-2h-spiro[imidazo[1,2-a]pyridine-3,4'-piperidin]-2-one

9. Ncgc00183853-01

10. Mosapramine Hydrochloride [jan]

11. 1'-(3-(3-chloro-10,11-dihydro-5h-dibenzo[b,f]azepin-5-yl)propyl)hexahydro-2h-spiro[imidazo[1,2-a]pyridine-3,4'-piperidin]-2-one

12. Unii-04uzq7o9sj

13. Mosapramine [mi]

14. Dsstox_cid_28772

15. Dsstox_rid_83041

16. Mosapramine [mart.]

17. Dsstox_gsid_48846

18. Mosapramine [who-dd]

19. 1'-[3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]spiro[1,5,6,7,8,8a-hexahydroimidazo[1,2-a]pyridine-3,4'-piperidine]-2-one

20. Schembl147139

21. Chembl2106650

22. Dtxsid0048846

23. Chebi:135775

24. Chebi:166972

25. 4,4-dichlorodiphenylsulfide

26. Tox21_113329

27. Bdbm50530438

28. Akos016014037

29. Db13676

30. Cas-89419-40-9

31. Hy-106584

32. Cs-0026106

33. D08235

34. L004956

35. Q6144116

36. (+-)-1'-(3-(3-chloro-10,11-dihydro-5h-dibenz(b,f)azepin-5-yl)propyl)hexahydrospiro(imidazo(1,2-a)pyridine-3(2h),4'-piperidin)-2-one

37. (+/-)-1'-(3-(3-chloro-10,11-dihydro-5h-dibenz(b,f)azepin-5-yl)propyl)hexahydrospiro(imidazo(1,2-a)pyridine-3(2h),4'-piperidin)-2-one

38. (- )-1'-(3-(3-chloro-10,11-dihydro-5h-dibenz(b,f)azepin-5-yl)propyl)hexahydrospiro(imidazo(1,2-a)pyridine-3(2h),4'-piperidin)-2-one.

2.4 Create Date
2005-03-25
3 Chemical and Physical Properties
Molecular Weight 479.1 g/mol
Molecular Formula C28H35ClN4O
XLogP35.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass478.2499394 g/mol
Monoisotopic Mass478.2499394 g/mol
Topological Polar Surface Area38.8 Ų
Heavy Atom Count34
Formal Charge0
Complexity725
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 ATC Code

N - Nervous system

N05 - Psycholeptics

N05A - Antipsychotics

N05AX - Other antipsychotics

N05AX10 - Mosapramine