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Overview of CAS 444731-75-3

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4CH-023623
PharmaCompass
4CH-023623
Also known as: 444731-75-3, N-(2-chloropyrimidin-4-yl)-n,2,3-trimethyl-2h-indazol-6-amine, 2h-indazol-6-amine, n-(2-chloro-4-pyrimidinyl)-n,2,3-trimethyl-, N-(2-chloropyrimidin-4-yl)-n-methyl-2,3-dimethyl-2h-indazol-6-amine, N-(2-chloro-4-pyrimidinyl)-n,2,3-trimethyl-2h-indazol-6-amine, 2h-indazol-6-amine,n-(2-chloro-4-pyrimidinyl)-n,2,3-trimethyl-
Molecular Formula
C14H14ClN5
Molecular Weight
287.751  g/mol
InChI Key
DVGMRZQSSNNTFY-UHFFFAOYSA-N

1 2D Structure

4CH-023623

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-(2-chloropyrimidin-4-yl)-N,2,3-trimethylindazol-6-amine
2.1.2 InChI
InChI=1S/C14H14ClN5/c1-9-11-5-4-10(8-12(11)18-20(9)3)19(2)13-6-7-16-14(15)17-13/h4-8H,1-3H3
2.1.3 InChI Key
DVGMRZQSSNNTFY-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=C2C=CC(=CC2=NN1C)N(C)C3=NC(=NC=C3)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 444731-75-3

2. N-(2-chloropyrimidin-4-yl)-n,2,3-trimethyl-2h-indazol-6-amine

3. 2h-indazol-6-amine, N-(2-chloro-4-pyrimidinyl)-n,2,3-trimethyl-

4. N-(2-chloropyrimidin-4-yl)-n-methyl-2,3-dimethyl-2h-indazol-6-amine

5. N-(2-chloro-4-pyrimidinyl)-n,2,3-trimethyl-2h-indazol-6-amine

6. 2h-indazol-6-amine,n-(2-chloro-4-pyrimidinyl)-n,2,3-trimethyl-

7. 6-[n-(2-chloro-4-pyrimidinyl)methylamino]-2,3-dimethyl-2h-indazole, 96%

8. Schembl589205

9. Ctk4i8238

10. Dtxsid70469403

11. Molport-006-827-061

12. Cs-b0769

13. Anw-44025

14. Mfcd12923006

15. N-(2-chloropyrimidin-4-yl)-n,2,3-trimethylindazol-6-amine

16. Zinc35928937

17. Akos015918031

18. Mcule-4415040405

19. Qc-5738

20. Rp29973

21. Vz32907

22. Ac-25865

23. Aj-92244

24. Ak-94428

25. He058346

26. Db-038010

27. Kb-258108

28. Tc-132770

29. 4ch-023623

30. Am20090657

31. Ft-0687641

32. St24048300

33. X3180

34. I14-8817

35. J-522901

36. F9995-1141

37. (2-chloro-pyrimidin-4-yl)-(2,3-dimethyl-2h-indazol-6-yl)-methyl-amine

38. 6-[n-(2-chloro-4-pyrimidinyl)methylamino]-2,3-dimethyl-2h-indazole

39. N-(2-chloropyrimidin-4-yl)-n-m Ethyl-2,3-dimethyl-2h-indazol-6- Amine

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 287.751 g/mol
Molecular Formula C14H14ClN5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass287.094 g/mol
Monoisotopic Mass287.094 g/mol
Topological Polar Surface Area46.8 A^2
Heavy Atom Count20
Formal Charge0
Complexity342
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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