Green Stone Swiss Co Ltd | CAS 26638-53-9 | End Use API | Intermediate

CAS 26638-53-9

Chemistry, 3 End Use API, 13 Related Intermediates

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Also known as: 26638-53-9, 3-chloro-6,11-dihydro-6-methyl-5,5,11-trioxodibenzo[c,f][1,2]thiazepine, 3-chloro-6-methyldibenzo[c,f][1,2]thiazepin-11(6h)-one 5,5-dioxide, 3-chloro-6-methyl-5,5-dioxobenzo[c][2,1]benzothiazepin-11-one, 3s1w61h5zk, Mfcd07368146

Molecular Formula

C₁₄H₁₀ClNO₃S

Molecular Weight

307.8 g/mol

InChI Key

RGOFXWXKWORKIP-UHFFFAOYSA-N

FDA UNII

3S1W61H5ZK

1 2D Structure

CAS 26638-53-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3-chloro-6-methyl-5,5-dioxobenzo[c][2,1]benzothiazepin-11-one

2.1.2 InChI

InChI=1S/C14H10ClNO3S/c1-16-12-5-3-2-4-10(12)14(17)11-7-6-9(15)8-13(11)20(16,18)19/h2-8H,1H3

2.1.3 InChI Key

RGOFXWXKWORKIP-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN1C2=CC=CC=C2C(=O)C3=C(S1(=O)=O)C=C(C=C3)Cl

2.2 Other Identifiers

2.2.1 UNII

3S1W61H5ZK

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 26638-53-9

2. 3-chloro-6,11-dihydro-6-methyl-5,5,11-trioxodibenzo[c,f][1,2]thiazepine

3. 3-chloro-6-methyldibenzo[c,f][1,2]thiazepin-11(6h)-one 5,5-dioxide

4. 3-chloro-6-methyl-5,5-dioxobenzo[c][2,1]benzothiazepin-11-one

5. 3s1w61h5zk

6. Mfcd07368146

7. 3-chloro-6-methyl-dibenzo(c,f)(1,2)thiazepin-11(6h)-one 5,5-dioxide

8. 3-chloro-6,11-dihydro-6-methyl-5,5,11-trioxodibenzo(c,f)(1,2)thiazepine

9. 3-chloro-6-methyl-dibenzo[c,f][1,2]thiazepin-11(6h)-one5,5-dioxide

10. Einecs 247-865-2

11. 3-chloro-6,11,-dihydro-6-methyl,5,511-trioxodibenzo[c,f][1,2]thiazepine

12. Unii-3s1w61h5zk

13. Schembl4258034

14. Dtxsid40949469

15. Ac-231

16. Zinc21298811

17. Akos015889342

18. Ds-10535

19. Sy030958

20. Am20040055

21. Cs-0144521

22. Ft-0651577

23. 638c539

24. A818540

25. Tianeptine Sodium Impurity C [ep Impurity]

26. Q-100334

27. 8-chloro-10-dioxo-11-methyl-dibenzo[c,f][1,2]thiazepine-5-one

28. 3-chloro-6,11-dihydro-6-methyl,5,511-trioxodibenzo[c,f][1,2]thiazepine

29. 3-chloro-6-methyl-5h-5lambda~6~-dibenzo[c,f][1,2]thiazepine-5,5,11(6h)-trione

30. 3-chloro-6-methyldibenzo(c,f)(1,2)thiazepin-11(6h)-one S,s-dioxide

31. Dibenzo(c,f)(1,2)thiazepin-11(6h)-one, 3-chloro-6-methyl-, 5,5-dioxide

32. 3-chloro-6-methyl-5,5-dioxo-benzo[c][2,1]benzothiazepin-11-one;3-chloro-6,11-dihydro-6-methyl-5,5,11-trioxodibenzo[c,f][1,2]thiazepine

2.4 Create Date

2007-02-09

3 Chemical and Physical Properties

Molecular Formula	C₁₄H₁₀ClNO₃S
Molecular Weight	307.8 g/mol
XLogP3	2.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	307.0069920 g/mol
Monoisotopic Mass	307.0069920 g/mol
Topological Polar Surface Area	62.8 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	501
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	1

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CAS Number

26638-53-9

Intermediate Name

3-chloro-6-methyl-dibenzo[c,f][1,2]...

About the Company

Green Stone Swiss Co ., ltd.is a high-tech enterprise of pharmaceuticals and health ingredients, and prov...

Green Stone Swiss Co ., ltd.is a high-tech enterprise of pharmaceuticals and health ingredients, and provide customized products/OEM/ODM. We signed technical cooperation agreements with 7 Universities of Europe, USA and China, equipped with a set of advanced production and testing equipment to ensure product quality. Our manufactures Factory has first-class production equipment and strict quality management system, which covers an area of 6000 square meters, packing workshop covers 1800 square meters, laboratory covers 260 square meters, building area of 1600 square meters.

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