loader
Please Wait
Applying Filters...

Minakem Generic APIs Minakem Generic APIs

X
menu

    Market Place

    Market Place

    Post Enquiry

    Post Enquiry
    menu

    Technical details about CAS 141645-23-0, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
    Menu

    CAS 141645-23-0

    Manufacturers/Suppliers

    PharmaCompass

    Symbiotec: Global API manufacturer, specializing in Cortico-Steroids & Steroid-Hormone APIs.

    Metrochem has been delivering customized volume & quality products to customers across the world, taking utmost care of their needs.

    2D Structure
    1. Also known as: 141645-23-0, (2-butyl-5-nitro-3-benzofuranyl)[4-[3-(dibutylamino)propoxy]phenyl]methanone, (2-butyl-5-nitro-1-benzofuran-3-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone, 2-butyl-3-(4-[3-(dibutylamino)propoxy]benzoyl)-5-nitrobenzofuran, 2-butyl-3-(4-[3-(dibutylamino)propoxy]benzoyl]-5-nitrobenzofuran, Methanone, (2-butyl-5-nitro-3-benzofuranyl)[4-[3-(dibutylamino)propoxy]phenyl]-
    Molecular Formula
    C30H40N2O5
    Molecular Weight
    508.6  g/mol
    InChI Key
    YIYARJKYRBMMJG-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2-butyl-5-nitro-1-benzofuran-3-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone
    2.1.2 InChI
    InChI=1S/C30H40N2O5/c1-4-7-11-28-29(26-22-24(32(34)35)14-17-27(26)37-28)30(33)23-12-15-25(16-13-23)36-21-10-20-31(18-8-5-2)19-9-6-3/h12-17,22H,4-11,18-21H2,1-3H3
    2.1.3 InChI Key
    YIYARJKYRBMMJG-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCCCC1=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)OCCCN(CCCC)CCCC
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 141645-23-0

    2. (2-butyl-5-nitro-3-benzofuranyl)[4-[3-(dibutylamino)propoxy]phenyl]methanone

    3. (2-butyl-5-nitro-1-benzofuran-3-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone

    4. 2-butyl-3-(4-[3-(dibutylamino)propoxy]benzoyl)-5-nitrobenzofuran

    5. 2-butyl-3-(4-[3-(dibutylamino)propoxy]benzoyl]-5-nitrobenzofuran

    6. Methanone, (2-butyl-5-nitro-3-benzofuranyl)[4-[3-(dibutylamino)propoxy]phenyl]-

    7. 2-butyl-3-(4-(3-dibutylaminopropoxy)benzoyl)-5-nitrobenzofuran

    8. Ec 444-800-1

    9. Schembl283110

    10. Dtxsid40436748

    11. Bcp09676

    12. Cs-m0183

    13. Mfcd18072491

    14. Zinc38386081

    15. (2-butyl-5-nitrobenzofuran-3-yl)(4-(3-dibutylaminopropoxy)phenyl)methanone

    16. Akos015901542

    17. Ac-25778

    18. As-73686

    19. Db-063393

    20. Ft-0701541

    21. 645b230

    22. 2-n-butyl-3-[4-(3-dibutylamino-propoxy)benzoyl]-5-nitro-benzofuran

    23. 2-(n-butyl)-3-(4-{3-[di(n-butyl)amino]propoxy}benzoyl)-5-nitrobenzofuran

    24. 2-butyl-5-nitrobenzofuran-3-yl[4-[3-(dibutylamino)propoxy]phenyl]methanone

    25. 2-n-butyl 3-[4-(3-di-n-butylamino-propoxy)benzoyl]-5-nitro Benzofuran

    26. 2-n-butyl-3-[4-(3-di-n-butylamino-propoxy)benzoyl]-5-nitro Benzofuran

    27. (2-butyl-5-nitro-1-benzofuran-3-yl){4-[3-(dibutylamino)propoxy]phenyl}methanone

    28. Dibutyl({3-[4-(2-butyl-5-nitro-1-benzofuran-3-carbonyl)phenoxy]propyl})amine

    2.3 Create Date
    2006-10-25
    3 Chemical and Physical Properties
    Molecular Weight 508.6 g/mol
    Molecular Formula C30H40N2O5
    XLogP38.1
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count16
    Exact Mass508.29372238 g/mol
    Monoisotopic Mass508.29372238 g/mol
    Topological Polar Surface Area88.5 Ų
    Heavy Atom Count37
    Formal Charge0
    Complexity667
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    Post Enquiry
    POST ENQUIRY