propoxyphene
TL;DR: propoxyphene (CAS 77-50-9) is a chemical compound with molecular formula C22H29NO2 and molecular weight 339.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] propanoate
Also Known As: propoxyphene, l-Propoxyphene, Levopropoxyphene, Letusin, Dextropropoxyphene
| Molecular Formula | C22H29NO2 |
|---|---|
| Molecular Weight | 339.22 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 339.21982 |
| Heavy Atoms | 25 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 77-50-9 |
|---|---|
| SMILES | CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C |
| InChIKey | XLMALTXPSGQGBX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
propoxyphene (CAS 77-50-9), with molecular formula C22H29NO2 and molecular weight 339.22 g/mol. IUPAC: [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] propanoate.
Chemical Property Profile of propoxyphene
Property Insights of propoxyphene
The XLogP value of 4.2 indicates that propoxyphene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, propoxyphene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, propoxyphene has 0 hydrogen bond donor(s) and 3 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 propoxyphene?
The CAS number of propoxyphene is 77-50-9.
What is the molecular formula of propoxyphene?
The molecular formula of propoxyphene is C22H29NO2.
What is the molecular weight of propoxyphene?
The molecular weight of propoxyphene is 339.22 g/mol.
Where can I buy propoxyphene?
You can request a quote for propoxyphene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propoxyphene?
Yes, KEHONG BIO provides custom synthesis services for propoxyphene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.