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CHEMISTRY
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ACTIVE PHARMA INGREDIENTS

1 NDC API, 1 VMF

1 NDC API
1 VMF

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Synopsis

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Chemistry

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Also known as: Sulfachloropyridazine sodium, 23282-55-5, Sulfachlorpyridazine sodium, Sodium sulfachlorpyridazine, Sodium sulfachloropyridazine, Sulfachlorpyridazine sodium salt

Molecular Formula

C₁₀H₈ClN₄NaO₂S

Molecular Weight

306.70 g/mol

InChI Key

ODWMXYHUKDMPTR-UHFFFAOYSA-N

FDA UNII

N1LMA4960O

1 2D Structure

Sulfachlorpyridazine Sodium

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

sodium;(4-aminophenyl)sulfonyl-(6-chloropyridazin-3-yl)azanide

2.1.2 InChI

InChI=1S/C10H8ClN4O2S.Na/c11-9-5-6-10(14-13-9)15-18(16,17)8-3-1-7(12)2-4-8;/h1-6H,12H2;/q-1;+1

2.1.3 InChI Key

ODWMXYHUKDMPTR-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=CC=C1N)S(=O)(=O)[N-]C2=NN=C(C=C2)Cl.[Na+]

2.2 Other Identifiers

2.2.1 UNII

N1LMA4960O

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. Sulfachloropyridazine Sodium

2. 23282-55-5

3. Sulfachlorpyridazine Sodium

4. Sodium Sulfachlorpyridazine

5. Sodium Sulfachloropyridazine

6. Sulfachlorpyridazine Sodium Salt

7. N1lma4960o

8. Sodium ((4-aminophenyl)sulfonyl)(6-chloropyridazin-3-yl)amide

9. Sodium;(4-aminophenyl)sulfonyl-(6-chloropyridazin-3-yl)azanide

10. Vetisulid

11. Sodium N-(6-chloropyridazin-3-yl)sulphanilamidate

12. Benzenesulfonamide, 4-amino-n-(6-chloro-3-pyridazinyl)-, Sodium Salt (1:1)

13. Sulfachloropyridazinesodium

14. Unii-n1lma4960o

15. Einecs 245-553-0

16. N-(6-chloro-3-pyridazine)-4-aminobenzenesulfonainino Sodium Monohydrate

17. Sodium[(4-aminophenyl)sulfonyl](6-chloropyridazin-3-yl)azanide

18. Sulphachloropyridazine Sodium

19. Schembl203597

20. Dtxsid10945973

21. Sulfanilamide, N1-(6-chloro-3-pyridazinyl)-, Monosodium Salt

22. Sulfachlororpyridazine Sodium

23. Bcp12153

24. Mfcd04117866

25. Akos027340239

26. Benzenesulfonamide, 4-amino-n-(6-chloro-3-pyridazinyl)-, Monosodium Salt

27. As-13676

28. Sulfachlorpyridazine Sodium Salt [mi]

29. H11378

30. Sulfachlorpyridazine Sodium [green Book]

31. 282s555

32. A816655

33. W-107411

34. Q27284398

35. Sodium (4-aminophenylsulfonyl)(6-chloropyridazin-3-yl)amide

36. Sodium (4-aminobenzene-1-sulfonyl)(6-chloropyridazin-3-yl)azanide

2.4 Create Date

2007-02-12

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₈ClN₄NaO₂S
Molecular Weight	306.70 g/mol
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	305.9954187 g/mol
Monoisotopic Mass	305.9954187 g/mol
Topological Polar Surface Area	95.3 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	370
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2