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    Roxatidine

    ACTIVE PHARMA INGREDIENTS

    INTERMEDIATES

    FINISHED DOSAGE FORMULATIONS

    GLOBAL SALES INFORMATION

    REF. STANDARDS & IMPURITIES

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    2D Structure
    Also known as: 78273-80-0, Desacetyl-tzu-0460, 2-hydroxy-n-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]acetamide, Iv9vht3yum, Roxatidine (inn), Roxatidine [inn]
    Molecular Formula
    C17H26N2O3
    Molecular Weight
    306.4  g/mol
    InChI Key
    BCCREUFCSIMJFS-UHFFFAOYSA-N
    FDA UNII
    IV9VHT3YUM
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-hydroxy-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]acetamide
    2.1.2 InChI
    InChI=1S/C17H26N2O3/c20-14-17(21)18-8-5-11-22-16-7-4-6-15(12-16)13-19-9-2-1-3-10-19/h4,6-7,12,20H,1-3,5,8-11,13-14H2,(H,18,21)
    2.1.3 InChI Key
    BCCREUFCSIMJFS-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CO
    2.2 Other Identifiers
    2.2.1 UNII
    IV9VHT3YUM
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Roxatidine Acetate

    2. Roxatidine Acetate Hydrochloride

    3. Roxiwas

    4. Zarocs

    2.3.2 Depositor-Supplied Synonyms

    1. 78273-80-0

    2. Desacetyl-tzu-0460

    3. 2-hydroxy-n-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]acetamide

    4. Iv9vht3yum

    5. Roxatidine (inn)

    6. Roxatidine [inn]

    7. Roxatidine [inn:ban]

    8. Unii-iv9vht3yum

    9. 2-hydroxy-n-(3-(3-(piperidin-1-ylmethyl)phenoxy)propyl)acetamide

    10. 2-hydroxy-n-{3-[3-(1-piperidinylmethyl)phenoxy]propyl}acetamide

    11. 2-hydroxy-n-(3-(3-(1-piperidinylmethyl)phenoxy)propyl)acetamide

    12. Roxit (tn)

    13. 2-hydroxy-n-[3-[3-(1-piperidylmethyl)phenoxy]propyl]acetamide

    14. Roxatidine [vandf]

    15. Schembl1394

    16. Roxatidine [who-dd]

    17. Chembl4802233

    18. Dtxsid30228937

    19. Bcp13552

    20. Zinc1541892

    21. Acetamide, 2-hydroxy-n-(3-(3-(1-piperidinylmethyl)phenoxy)propyl)-

    22. Mfcd00871807

    23. Akos015896584

    24. Sy293181

    25. Hy-137941

    26. Cs-0143056

    27. Ft-0756141

    28. D08494

    29. 273r800

    30. L012909

    31. Q415039

    32. Sr-01000944538

    33. Sr-01000944538-1

    34. N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]hydroxyacetamide

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 306.4 g/mol
    Molecular Formula C17H26N2O3
    XLogP31.5
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count8
    Exact Mass306.19434270 g/mol
    Monoisotopic Mass306.19434270 g/mol
    Topological Polar Surface Area61.8 Ų
    Heavy Atom Count22
    Formal Charge0
    Complexity319
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Histamine H2 Antagonists

    Drugs that selectively bind to but do not activate histamine H2 receptors, thereby blocking the actions of histamine. Their clinically most important action is the inhibition of acid secretion in the treatment of gastrointestinal ulcers. Smooth muscle may also be affected. Some drugs in this class have strong effects in the central nervous system, but these actions are not well understood. (See all compounds classified as Histamine H2 Antagonists.)

    Anti-Ulcer Agents

    Various agents with different action mechanisms used to treat or ameliorate PEPTIC ULCER or irritation of the gastrointestinal tract. This has included ANTIBIOTICS to treat HELICOBACTER INFECTIONS; HISTAMINE H2 ANTAGONISTS to reduce GASTRIC ACID secretion; and ANTACIDS for symptomatic relief. (See all compounds classified as Anti-Ulcer Agents.)

    4.2 ATC Code

    A - Alimentary tract and metabolism

    A02 - Drugs for acid related disorders

    A02B - Drugs for peptic ulcer and gastro-oesophageal reflux disease (gord)

    A02BA - H2-receptor antagonists

    A02BA06 - Roxatidine