Fenpiverinium bromideProduct ingredient for Fenpiverinium
- Name
- Fenpiverinium bromide
- Drug Entry
- Fenpiverinium
- Accession Number
- DBSALT003077
- Structure
Structure for Fenpiverinium bromide (DBSALT003077)
- Synonyms
- Bromure de fenpiverinium / Bromuro de fempiverinio / Fenpipramide bromomethylate / Fenpiverinii bromidum / Fenpiverinium bromide
- External IDs
- 204-744-9
- UNII
- 36479UA8GL
- CAS Number
- 125-60-0
- Weight
- Average: 417.391
Monoisotopic: 416.146327 - Chemical Formula
- C22H29BrN2O
- InChI Key
- PMAHPMMCPXYARU-UHFFFAOYSA-N
- InChI
- InChI=1S/C22H28N2O.BrH/c1-24(16-9-4-10-17-24)18-15-22(21(23)25,19-11-5-2-6-12-19)20-13-7-3-8-14-20;/h2-3,5-8,11-14H,4,9-10,15-18H2,1H3,(H-,23,25);1H
- IUPAC Name
- 1-(3-carbamoyl-3,3-diphenylpropyl)-1-methylpiperidin-1-ium bromide
- SMILES
- [Br-].C[N+]1(CCC(C(N)=O)(C2=CC=CC=C2)C2=CC=CC=C2)CCCCC1
- External Links
- ChemSpider
- 64565
- ChEMBL
- CHEMBL2106138
- Predicted Properties
Property Value Source Water Solubility 2.05e-05 mg/mL ALOGPS logP 0.38 ALOGPS logP -0.56 Chemaxon logS -7.3 ALOGPS pKa (Strongest Acidic) 16.19 Chemaxon pKa (Strongest Basic) -3.3 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 1 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 43.09 Å2 Chemaxon Rotatable Bond Count 6 Chemaxon Refractivity 114.55 m3·mol-1 Chemaxon Polarizability 38.74 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon