Rabeprazole
Properties
- Molecular formula
- C18H21N3O3S
- Molar mass
- 359.44 g/mol
- Exact mass
- 359.1304 Da
- Melting point
- 99–100 °C (decomposes)
- logP
- 2.99Crippen estimate
- Polar surface area
- 77.1 Ų
- H-bond donors / acceptors
- 1 / 5
- Rotatable bonds
- 8
Hazards
Warning
- H315 Causes skin irritation92.9% of notifiers
- H319 Causes serious eye irritation92.9% of notifiers
- H335 May cause respiratory irritation92.9% of notifiers
Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
117976-89-3SMILES
COCCCOc1ccnc(CS(=O)c2nc3ccccc3[nH]2)c1CInChIKey
YREYEVIYCVEVJK-UHFFFAOYSA-NInChI
InChI=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)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
17 names · show all
- 1H-Benzimidazole, 2-[[[4-(3-methoxypropoxy)-3-methyl-2-pyridinyl]methyl]sulfinyl]-
- 2-[[[4-(3-Methoxypropoxy)-3-methyl-2-pyridinyl]methyl]sulfinyl]-1H-benzimidazole
- 2-[[[4-(3-Methoxypropoxy)-3-methyl-2-pyridyl]methyl]sulfinyl]benzimidazole
- LY 307640
- 2-[[[3-Methyl-4-(3-methoxypropoxy)-2-pyridyl]methyl]sulfinyl]-1H-benzimidazole
- Pariets
- 2-[[[4-(3-Methoxypropoxy)-3-methyl-2-pyridyl]methyl]sulfinyl]-1H-benzimidazole
- 2-[[[4-(3-Methoxypropoxy)-3-methylpyridin-2-yl]methyl]sulfinyl]-1H-benzimidazole
- Habeprazole
- (±)-Rabeprazole
- 2-[[[3-Methyl-4-(3-methoxypropoxy)-2-pyridinyl]methyl]sulfinyl]-1H-benzimidazole
- Rabeloc
- Rabiral
- Newprazole
- Rabemax
- Dexrabeprazol
- 2-[4-(3-Methoxy-propoxy)-3-methyl-pyridin-2-ylmethanesulfinyl]-1H-benzoimidazole
Work with Rabeprazole
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Lansoprazole103577-45-370 % similar
(+)-Lansoprazole138530-94-670 % similar
Rabeprazole-thioether117977-21-667 % similar
Ilaprazole172152-36-255 % similar
2-(Chloromethyl)-4-(3-methoxypropoxy)-3-methylpyridine117977-20-550 % similar
4-(3-Methoxypropoxy)-3-methyl-2-pyridinemethanol118175-10-350 % similar
2-Chloromethyl-4-(3-methoxypropoxy)-3-methylpyridine hydrochloride153259-31-548 % similar
2-Hydroxymethyl-4-(3-methoxypropoxy)-3-methylpyridine hydrochloride675198-19-348 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.