Cas no 117976-91-7 (Desmethyl rabeprazole thioether)

Desmethyl rabeprazole thioether structure
117976-91-7 structure
Product Name:Desmethyl rabeprazole thioether
CAS No:117976-91-7
MF:C17H19N3O2S
MW:329.416662454605
CID:63326
PubChem ID:15166260
Update Time:2025-04-18

Desmethyl rabeprazole thioether Chemical and Physical Properties

Names and Identifiers

    • Desmethyl rabeprazole thioether
    • 2-[[[4-(3-Hydroxypropoxy)-3-methyl-2-pyridyl]methyl]thio]-1H-benzimidazole
    • 3-[[2-[(1H-Benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridinyl]oxy]-1-propanol
    • 3-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methylpyridin-4-yl]oxypropan-1-ol
    • 1-Propanol,3-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridinyl]oxy]
    • 2-[{4-(3-hydroxypropoxy)-3-methylpyridin-2-yl}methylthio]-1H-benzimidazole
    • 2-[{4-(3-hydroxypropoxy)-3-methylpyridine-2-yl}methylthio]-1H-benzimidazole
    • Demethyl-Rabeprazole Thioether
    • RaBeprazole Impurity 7
    • 1-Propanol,3-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridinyl]oxy]-
    • WKTPBAPTLLDMKZ-UHFFFAOYSA-N
    • 3-[(2-{[(1H-Benzimidazol-2-yl)sulfanyl]methyl}-3-methylpyridin-4-yl)oxy]propan-1-ol
    • SCHEMBL600640
    • DTXSID30569438
    • 60DBG5I1US
    • FT-0742598
    • 3-((2-(((1H-Benzo[d]imidazol-2-yl)thio)methyl)-3-methylpyridin-4-yl)oxy)propan-1-ol
    • 3-((2-(((1H-benzo[d]imidazol-2-yl)thio)methyl)-3-methylpyridin-4-yl)oxy)propan-1-ol? (Rabeprazole Impurity
    • 1-Propanol, 3-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridinyl]oxy]-
    • NS00116671
    • UNII-60DBG5I1US
    • 3-((2-((1H-benzo[d]imidazol-2-yl)thio)-3-methylpyridin-4-yl)oxy)propan-1-ol
    • Q27263215
    • 1-Propanol, 3-((2-((1H-benzimidazol-2-ylthio)methyl)-3-methyl-4-pyridinyl)oxy)-
    • CS-0166558
    • 117976-91-7
    • F93953
    • 2-[{4-(3-Hydroxypropoxy)-3-Methylpyridine-2-Yl}-Methylthio]-1H-Benzimidazole
    • AKOS015842452
    • AC-22628
    • Desmethyl rabeprazolethioether
    • RABEPRAZOLE_met020
    • Inchi： 1S/C17H19N3O2S/c1-12-15(18-8-7-16(12)22-10-4-9-21)11-23-17-19-13-5-2-3-6-14(13)20-17/h2-3,5-8,21H,4,9-11H2,1H3,(H,19,20)
    • InChI Key： WKTPBAPTLLDMKZ-UHFFFAOYSA-N
    • SMILES： S(C1=NC2C=CC=CC=2N1)CC1C(C)=C(C=CN=1)OCCCO

Computed Properties

  • Exact Mass: 329.12000
  • Monoisotopic Mass: 329.11979803g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 7
  • Complexity: 361
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.8
  • Topological Polar Surface Area: 96.3?2

Experimental Properties

  • Density: 1.32
  • Boiling Point: 572.5°C at 760 mmHg
  • Flash Point: 300.1°C
  • Refractive Index: 1.673
  • PSA: 96.33000
  • LogP: 3.31980

Desmethyl rabeprazole thioether Related Literature

117976-91-7 (Desmethyl rabeprazole thioether) Related Products

Recommended suppliers
上海嶸奧生物技術(shù)有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
上海嶸奧生物技術(shù)有限公司
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Jinan Hanyu Chemical Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinan Hanyu Chemical Co.,Ltd.
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Xiamen PinR Bio-tech Co., Ltd.
Hebei Liye chemical Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hebei Liye chemical Co.,Ltd