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Overview of 3-(2-Chloroethyl)-2-Methyl-4H-Pyrido[1,2-A]Pyrimidin-4-One

Client Email Product
4H-Pyrido[1,2-a]pyrimidin-4-one,3-(2-chloroethyl)-2-methyl-
PharmaCompass
4H-Pyrido[1,2-a]pyrimidin-4-one,3-(2-chloroethyl)-2-methyl-
Also known as: 41078-70-0, 3-(2-chloroethyl)-2-methyl-4h-pyrido[1,2-a]pyrimidin-4-one, 3-(2-chloroethyl)-2-methylpyrido[1,2-a]pyrimidin-4-one, 3-(2-chloroethyl)-2-methyl-4h-pyrido-[1,2-a]pyrimidin-4-one, 3-(2-chloro-ethyl)-2-methyl-pyrido[1,2-a]pyrimidin-4-one, 3-(2-chloroethyl)-2-methyl-4h-pyrido(1,2-a)pyrimidin-4-one
Molecular Formula
C11H11ClN2O
Molecular Weight
222.672  g/mol
InChI Key
LFTGLYCNMGGMKL-UHFFFAOYSA-N

1 2D Structure

4H-Pyrido[1,2-a]pyrimidin-4-one,3-(2-chloroethyl)-2-methyl-

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-(2-chloroethyl)-2-methylpyrido[1,2-a]pyrimidin-4-one
2.1.2 InChI
InChI=1S/C11H11ClN2O/c1-8-9(5-6-12)11(15)14-7-3-2-4-10(14)13-8/h2-4,7H,5-6H2,1H3
2.1.3 InChI Key
LFTGLYCNMGGMKL-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=C(C(=O)N2C=CC=CC2=N1)CCCl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 41078-70-0

2. 3-(2-chloroethyl)-2-methyl-4h-pyrido[1,2-a]pyrimidin-4-one

3. 3-(2-chloroethyl)-2-methylpyrido[1,2-a]pyrimidin-4-one

4. 3-(2-chloroethyl)-2-methyl-4h-pyrido-[1,2-a]pyrimidin-4-one

5. 3-(2-chloro-ethyl)-2-methyl-pyrido[1,2-a]pyrimidin-4-one

6. 3-(2-chloroethyl)-2-methyl-4h-pyrido(1,2-a)pyrimidin-4-one

7. 4h-pyrido[1,2-a]pyrimidin-4-one, 3-(2-chloroethyl)-2-methyl-

8. Einecs 255-207-0

9. Ac1lga2x

10. Ac1q3uik

11. Mls006010917

12. Schembl1444060

13. Ctk4i4236

14. Dtxsid70194041

15. Molport-003-801-261

16. Zinc332182

17. Act04283

18. Ks-000010ey

19. Anw-75363

20. Mfcd03085747

21. Sbb070813

22. Akos015895865

23. Ac-3456

24. Qc-7782

25. Vz34925

26. Aj-19520

27. Ak106087

28. An-12967

29. As-16100

30. S378

31. Smr002530025

32. Zb010632

33. Ab0006439

34. Db-049712

35. Kb-177119

36. Kb-232613

37. Tc-164108

38. 4ch-024323

39. Bg01525825

40. Ft-0639694

41. St24041395

42. A-1821

43. 078c700

44. Ae-406/41056944

45. Sr-01000945071

46. I06-1306

47. Sr-01000945071-1

48. W-106323

49. 3-(2-chloroethyl)-2-methyl-pyrido[1,2-a]pyrimidin-4-one

50. 2-methyl-3-(2-chloroethyl)-4h-pyrido[1,2-a)pyrimidin-4-one

51. 3-(2-chloro-ethyl)-2-methyl-4h-pyrido[1,2-a]pyrimidin-4-one

52. 3-(2-chloroethyl)-2-methyl-4h-pyri-do[1,2-a]pyrimidin-4-one

53. 3-(2-chloroethyl)-2-methyl-4h-pyrido-[1,2-a]pyrimidin-4one

54. 3-(2-chloroethyl)-2-methyl-4h-pyrido[1,2-a ]pyrimidin-4-one

55. 3-(2-chloroethyl)-2-methyl-4h-pyrido[1,2-a]pyrimidine-4-one

56. 4h-pyrido[1,2-a]pyrimidin-4-one,3-(2-chloroethyl)-2-methyl-

57. 3-(2-chloroethyl)-2-methyl-4h-pyrido[1,2-a] Pyrimnidin-4-one

58. 3-(2-chloroethyl)-2-methyl-5-hydropyridino[1,2-a]pyrimidin-4-one

2.3 Create Date
2005-07-08
3 Chemical and Physical Properties
Molecular Weight 222.672 g/mol
Molecular Formula C11H11ClN2O
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass222.056 g/mol
Monoisotopic Mass222.056 g/mol
Topological Polar Surface Area32.7 A^2
Heavy Atom Count15
Formal Charge0
Complexity418
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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