Trimebutine maleateProduct ingredient for Trimebutine
- Name
- Trimebutine maleate
- Drug Entry
- Trimebutine
Trimebutine is a spasmolytic agent that regulates intestinal and colonic motility and relieves abdominal pain with antimuscarinic and weak mu opioid agonist effects. It is marketed for the treatment of irritable bowel syndrome (IBS) and lower gastrointestinal tract motility disorders, with IBS being one of the most common multifactorial GI disorders 2. It is used to restore normal bowel function and is commonly present in pharmaceutical mixtures as trimebutine maleate salt form. Trimebutine is not a FDA-approved drug, but it is available in Canada and several other international countries.
- Accession Number
- DBSALT001129
- Structure
Structure for Trimebutine maleate (DBSALT001129)
- Synonyms
- Not Available
- UNII
- 2A051GM4YM
- CAS Number
- 34140-59-5
- Weight
- Average: 503.548
Monoisotopic: 503.215531647 - Chemical Formula
- C26H33NO9
- InChI Key
- FSRLGULMGJGKGI-BTJKTKAUSA-N
- InChI
- InChI=1S/C22H29NO5.C4H4O4/c1-7-22(23(2)3,17-11-9-8-10-12-17)15-28-21(24)16-13-18(25-4)20(27-6)19(14-16)26-5;5-3(6)1-2-4(7)8/h8-14H,7,15H2,1-6H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
- IUPAC Name
- (2Z)-but-2-enedioic acid; 2-(dimethylamino)-2-phenylbutyl 3,4,5-trimethoxybenzoate
- SMILES
- [H]\C(=C(/[H])C(O)=O)C(O)=O.CCC(COC(=O)C1=CC(OC)=C(OC)C(OC)=C1)(N(C)C)C1=CC=CC=C1
- External Links
- ChemSpider
- 4445578
- ChEBI
- 32261
- ChEMBL
- CHEMBL1325297
- Predicted Properties
Property Value Source Water Solubility 0.019 mg/mL ALOGPS logP 3.94 ALOGPS logP 4.11 Chemaxon logS -4.3 ALOGPS pKa (Strongest Basic) 8.48 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 57.23 Å2 Chemaxon Rotatable Bond Count 12 Chemaxon Refractivity 108.94 m3·mol-1 Chemaxon Polarizability 42.32 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon