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    CAS 26638-53-9

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    CAS 26638-53-9
    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 Weight 307.8 g/mol
    Molecular Formula C14H10ClNO3S
    XLogP32.8
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count0
    Exact Mass307.0069920 g/mol
    Monoisotopic Mass307.0069920 g/mol
    Topological Polar Surface Area62.8 Ų
    Heavy Atom Count20
    Formal Charge0
    Complexity501
    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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      Shandong Chenghui Shuangda Pharmaceutical Co., Ltd. is specialized in R&D and production of APIs and advanced intermediates. With 22 years of production experience,the company has 6 workshops and 9 production lines which has 100t/month production capacity.The company is committed to maintain the standards with continuous improvements to the current standards throughout the product lifecycle.The main products include local anesthetic drugs, antiviral drugs, cardiovascular and cerebrovascular drugs, antitumor drugs, gastrointestinal drugs, diabetic drugs, veterinary drugs, and CDMO products.
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        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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          Jinan Chenghui Shuangda Chemical Co., Ltd is subordinate to Chengchuang Pharmaceutical Group, which is formally established in March, 2002. It is a high-tech enterprise professionally producing pharmaceutical intermediates and fine chemical products inland. The company is located in Chengchuang industrial park, high-tech development district, Ji’nan, the capital city of Shandong Province. It is 1km far from Longitude Ten Road which is the main road of Jinan city, 5km from high way surrounding Ji’nan city and 25km from Yaoqiang airport in Ji’nan. It has superior geographic location and the traffic is very convenient.
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