Fesoterodine fumarateProduct ingredient for Fesoterodine
- Name
- Fesoterodine fumarate
- Drug Entry
- Fesoterodine
Fesoterodine is an antimuscarinic prodrug for the treatment of overactive bladder syndrome.
- Accession Number
- DBSALT000085
- Structure
- Synonyms
- Fesoterodine fumarate
- External IDs
- SPM 8272 / SPM 907
- UNII
- EOS72165S7
- CAS Number
- 286930-03-8
- Weight
- Average: 527.649
Monoisotopic: 527.288302671 - Chemical Formula
- C30H41NO7
- InChI Key
- MWHXMIASLKXGBU-RNCYCKTQSA-N
- InChI
- InChI=1S/C26H37NO3.C4H4O4/c1-18(2)26(29)30-25-13-12-21(17-28)16-24(25)23(22-10-8-7-9-11-22)14-15-27(19(3)4)20(5)6;5-3(6)1-2-4(7)8/h7-13,16,18-20,23,28H,14-15,17H2,1-6H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t23-;/m1./s1
- IUPAC Name
- (2E)-but-2-enedioic acid; 2-[(1R)-3-[bis(propan-2-yl)amino]-1-phenylpropyl]-4-(hydroxymethyl)phenyl 2-methylpropanoate
- SMILES
- [H]\C(=C(\[H])C(O)=O)C(O)=O.[H][C@@](CCN(C(C)C)C(C)C)(C1=CC=CC=C1)C1=C(OC(=O)C(C)C)C=CC(CO)=C1
- External Links
- PubChem Compound
- 9849808
- ChemSpider
- 8025521
- BindingDB
- 50248002
- ChEMBL
- CHEMBL1201765
- Wikipedia
- Fesoterodine
- Predicted Properties
Property Value Source Water Solubility 0.00205 mg/mL ALOGPS logP 5.45 ALOGPS logP 5.7 Chemaxon logS -5.3 ALOGPS pKa (Strongest Acidic) 14.98 Chemaxon pKa (Strongest Basic) 10.64 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 49.77 Å2 Chemaxon Rotatable Bond Count 13 Chemaxon Refractivity 124.08 m3·mol-1 Chemaxon Polarizability 48.32 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