Flutropium
TL;DR: Flutropium (CAS 754131-59-4) is a chemical compound with molecular formula C24H29FNO3+ and molecular weight 398.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,5S)-8-(2-fluoroethyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2,2-diphenylacetate
Also Known As: Flutropium, Flutropium ion, Flutropium cation, flutropium bromide, Flutropium [WHO-DD]
| Molecular Formula | C24H29FNO3+ |
|---|---|
| Molecular Weight | 398.21 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 398.21313 |
| Heavy Atoms | 29 |
| Complexity | 538.0 |
Chemical Identifiers
| CAS Number | 754131-59-4 |
|---|---|
| SMILES | C[N+]1([C@@H]2CC[C@H]1CC(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)CCF |
| InChIKey | OATDVDIMNNZTEY-MYWYYWIJSA-N |
Product Overview
Flutropium (CAS 754131-59-4), with molecular formula C24H29FNO3+ and molecular weight 398.21 g/mol. IUPAC: [(1R,5S)-8-(2-fluoroethyl)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2,2-diphenylacetate.
Chemical Property Profile of Flutropium
Property Insights of Flutropium
The XLogP value of 4.2 indicates that Flutropium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Flutropium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Flutropium has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Flutropium?
The CAS number of Flutropium is 754131-59-4.
What is the molecular formula of Flutropium?
The molecular formula of Flutropium is C24H29FNO3+.
What is the molecular weight of Flutropium?
The molecular weight of Flutropium is 398.21 g/mol.
Where can I buy Flutropium?
You can request a quote for Flutropium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Flutropium?
Yes, KEHONG BIO provides custom synthesis services for Flutropium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.