1.02011-09-21 00:32:08 UTC2015-07-21 06:57:47 UTCFDB023595RabeprazoleRabeprazole is a proton pump inhibitor sold (as its sodium salt) under the brand names Aciphex and Pariet (distributed by Janssen-Cilag); Rabeprazole is a proton pump inhibitor sold (as its sodium salt) and it is used in the treatment of gastric ulcers and GERD (or heartburn). It is taken once a day along with a full glass of water (preferable 30 min before breakfast). [HMDB]AciphexClofezoneHabeprazoleParietParietsRabeprazole sodiumSodium rabeprazoleC18H21N3O3S359.443359.1303622432-{[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methanesulfinyl}-1H-1,3-benzodiazolerabeprazole117976-89-3COCCCOC1=C(C)C(CS(=O)C2=NC3=CC=CC=C3N2)=NC=C1InChI=1S/C18H21N3O3S/c1-13-16(19-9-8-17(13)24-11-5-10-23-2)12-25(22)18-20-14-6-3-4-7-15(14)21-18/h3-4,6-9H,5,10-12H2,1-2H3,(H,20,21)YREYEVIYCVEVJK-UHFFFAOYSA-N belongs to the class of organic compounds known as sulfinylbenzimidazoles. These are polycyclic aromatic compounds containing a sulfinyl group attached at the position 2 of a benzimidazole moiety.SulfinylbenzimidazolesOrganic compoundsOrganoheterocyclic compoundsBenzimidazolesSulfinylbenzimidazolesAromatic heteropolycyclic compoundsAlkyl aryl ethersAzacyclic compoundsBenzenoidsDialkyl ethersHeteroaromatic compoundsHydrocarbon derivativesImidazolesMethylpyridinesOrganic oxidesOrganonitrogen compoundsOrganopnictogen compoundsSulfinyl compoundsSulfoxidesAlkyl aryl etherAromatic heteropolycyclic compoundAzacycleAzoleBenzenoidDialkyl etherEtherHeteroaromatic compoundHydrocarbon derivativeImidazoleMethylpyridineOrganic nitrogen compoundOrganic oxideOrganic oxygen compoundOrganonitrogen compoundOrganooxygen compoundOrganopnictogen compoundOrganosulfur compoundPyridineSulfinyl compoundSulfinylbenzimidazoleSulfoxidebenzimidazolespyridinessulfoxideSolidlogp2.04logs-3.03solubility3.36e-01 g/llogp2.09pka_strongest_acidic9.35pka_strongest_basic4.24iupac2-{[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methanesulfinyl}-1H-1,3-benzodiazoleaverage_mass359.443mono_mass359.130362243smilesCOCCCOC1=C(C)C(CS(=O)C2=NC3=CC=CC=C3N2)=NC=C1formulaC18H21N3O3SinchiInChI=1S/C18H21N3O3S/c1-13-16(19-9-8-17(13)24-11-5-10-23-2)12-25(22)18-20-14-6-3-4-7-15(14)21-18/h3-4,6-9H,5,10-12H2,1-2H3,(H,20,21)inchikeyYREYEVIYCVEVJK-UHFFFAOYSA-Npolar_surface_area77.1refractivity98.07polarizability39.64rotatable_bond_count8acceptor_count5donor_count1physiological_charge0formal_charge0Specdb::CMs11249Specdb::CMs117487Specdb::CMs172516Specdb::MsMs262398Specdb::MsMs262399Specdb::MsMs262400Specdb::MsMs282330Specdb::MsMs282331Specdb::MsMs282332Specdb::MsMs2464206Specdb::MsMs2464207Specdb::MsMs2464208Specdb::MsMs2500745Specdb::MsMs2500746Specdb::MsMs2500747HMDB050268769Potassium-transporting ATPase alpha chain 1P20648ATP4APotassium-transporting ATPase subunit betaP51164ATP4B