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    CAS 878671-96-6

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    CAS 878671-96-6
    Also known as: 878671-96-6, Lesinurad impurity 12, 5-amino-4-(4-cyclopropyl-1-naphthalenyl)-2,4-dihydro-3h-1,2,4-triazole-3-thione, 3h-1,2,4-triazole-3-thione, 5-amino-4-(4-cyclopropyl-1-naphthalenyl)-2,4-dihydro, 3-amino-4-(4-cyclopropylnaphthalen-1-yl)-1h-1,2,4-triazole-5-thione, 3-amino-4-(4-cyclopropylnaphthalen-1-yl)-4h-1,2,4-triazole-5-thiol
    Molecular Formula
    C15H14N4S
    Molecular Weight
    282.4  g/mol
    InChI Key
    VHPOGQZYQNLNNN-UHFFFAOYSA-N
    1 2D Structure

    CAS 878671-96-6

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-amino-4-(4-cyclopropylnaphthalen-1-yl)-1H-1,2,4-triazole-5-thione
    2.1.2 InChI
    InChI=1S/C15H14N4S/c16-14-17-18-15(20)19(14)13-8-7-10(9-5-6-9)11-3-1-2-4-12(11)13/h1-4,7-9H,5-6H2,(H2,16,17)(H,18,20)
    2.1.3 InChI Key
    VHPOGQZYQNLNNN-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CC1C2=CC=C(C3=CC=CC=C23)N4C(=NNC4=S)N
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 878671-96-6

    2. Lesinurad Impurity 12

    3. 5-amino-4-(4-cyclopropyl-1-naphthalenyl)-2,4-dihydro-3h-1,2,4-triazole-3-thione

    4. 3h-1,2,4-triazole-3-thione, 5-amino-4-(4-cyclopropyl-1-naphthalenyl)-2,4-dihydro

    5. 3-amino-4-(4-cyclopropylnaphthalen-1-yl)-1h-1,2,4-triazole-5-thione

    6. 3-amino-4-(4-cyclopropylnaphthalen-1-yl)-4h-1,2,4-triazole-5-thiol

    7. 5-amino-4-(4-cyclopropylnaphthalen-1-yl)-4h-[1,2,4]triazole-3-thiol

    8. 5-amino-4-(4-cyclopropyl-naphthalen-1-yl)-4h-[1,2,4]triazole-3-thiol

    9. 5-amino-4-(4-cyclopropylnaphthalen-1-yl)-2,4-dihydro-3h-1,2,4-triazole-3-thione

    10. 3-amino-4-(4-cyclopropyl-1-naphthyl)-1h-1,2,4-triazole-5(4h)-thione

    11. Schembl249425

    12. Schembl15556488

    13. Dtxsid70676418

    14. Amy40361

    15. Bcp11531

    16. Mfcd09991698

    17. Zinc40435315

    18. Akos015855157

    19. Akos016012328

    20. Ds-6722

    21. Ac-30098

    22. Db-077123

    23. Cs-0012742

    24. Ft-0729511

    25. 5-amino-4-(1-cyclopropylnaphthalen-4-yl)-4h-1,2,4-triazole-3-thiol

    26. 5-amino-4-(4-cyclopropylnaphthalen-1-yl)4h-1,2,4-triazole-3-thiol

    27. 3h-1,2,4-triazole-3-thione,5-amino-4-(4-cyclopropyl-1-naphthalenyl)-2,4-dihydro-

    28. 5-amino-4-(4-cyclopropyl-1-naphthyl)-2,4-dihydro-3h-1,2,4-triazole-3-thione

    2.3 Create Date
    2010-08-06
    3 Chemical and Physical Properties
    Molecular Weight 282.4 g/mol
    Molecular Formula C15H14N4S
    XLogP33.1
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass282.09391764 g/mol
    Monoisotopic Mass282.09391764 g/mol
    Topological Polar Surface Area85.7 Ų
    Heavy Atom Count20
    Formal Charge0
    Complexity445
    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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      Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...
      Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.
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        Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...
        Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.
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          Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...
          Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.
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            Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...
            Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.
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              Lesinurad
              Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...
              Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.
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                4-cyclopropylnaphthalen-1-aMine hydrochloride

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                1533519-92-4
                Lesinurad
                Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...
                Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.
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                Founded in 1995, Shenzhen Oriental Pharma focussed on the production of Active Pharma Ingredients (APIs),...
                Founded in 1995, Shenzhen Oriental Pharma focussed on the production of Active Pharma Ingredients (APIs), Now the main product is Phenylephrine Hcl (PE), Doxylamine succinate.We have 14 years production experience for Phenylephrine Hcl, granted the GMP for PE in 2004,re-certified in 2009. A DMF has been submitted to FDA in 2005 (DMF # 18799), this product passed the US FDA inspection in March 2014. According to the customer’s needs, we can supply the APIs conforming to the current standard of USP, EP and CP .At the same time, we can supply various particle sizes product.
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                  Xi'an caijing opto-Electrical Science & Technology Co.,Ltd.(briefed as CJOE), located in Xi'an High-Tech ...
                  Xi'an caijing opto-Electrical Science & Technology Co.,Ltd.(briefed as CJOE), located in Xi'an High-Tech Development Zone with a registered capital of 90 million Yuan, is a high-tech joint-stock enterprise and has been engaged in manufacture, R & D and trade. Our major investors are well-known domestic institute and companies including: Xi'an Modern Chemistry Research Institute, Xi'an DongFang Group.,Ltd, Beijing Minghang Science & Technology Development Co., Ltd. etc. We have the self-supported import and export right and our business is dedicated to liquid crystal display materials, organic electroluminescent materials and fine chemicals.
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