Difenoxin
TL;DR: Difenoxin (CAS 28782-42-5) is a chemical compound with molecular formula C28H28N2O2 and molecular weight 424.2151 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylic acid
Also Known As: Difenoxin, Diphenoxylic acid, Difenoxine, Difenoxina, Difenoxinum
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C28H28N2O2 |
| Molecular Weight | 424.2151 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 64.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.2151 Da |
| Heavy Atoms | 32 |
| Complexity | 636.0 |
| SMILES | C1CN(CCC1(C2=CC=CC=C2)C(=O)O)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | UFIVBRCCIRTJTN-UHFFFAOYSA-N |
Chemical Property Profile of Difenoxin
Property Insights of Difenoxin
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Difenoxin. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Difenoxin. Following Lipinski's Rule of Five, Difenoxin 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
What is the CAS number of Difenoxin?
The CAS number of Difenoxin is 28782-42-5.
What is the molecular formula of Difenoxin?
The molecular formula of Difenoxin is C28H28N2O2.
What is the molecular weight of Difenoxin?
The molecular weight of Difenoxin is 424.2151 g/mol.
Where can I buy Difenoxin?
You can request a quote for Difenoxin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Difenoxin?
Yes, CoreyChem provides custom synthesis services for Difenoxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.