Difenoximide Hydrochloride
TL;DR: Difenoximide Hydrochloride (CAS 37800-79-6) is a chemical compound with molecular formula C32H32ClN3O4 and molecular weight 557.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dioxopyrrolidin-1-yl) 1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylate;hydrochloride
Also Known As: Difenoximide hydrochloride, Difenoximide HCl, DIFENOXIMIDE, Difenoximide hydrochloride [USAN], Difenoximide hydrochloride (USAN)
| Molecular Formula | C32H32ClN3O4 |
|---|---|
| Molecular Weight | 557.21 g/mol |
| LogP | 4.95 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 557.2081 |
| Heavy Atoms | 40 |
| Complexity | 894.0 |
Chemical Identifiers
| CAS Number | 37800-79-6 |
|---|---|
| SMILES | C1CC(=O)N(C1=O)OC(=O)C2(CCN(CC2)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.Cl |
| InChIKey | PAVHWTIATNTNMG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Difenoximide Hydrochloride (CAS 37800-79-6), with molecular formula C32H32ClN3O4 and molecular weight 557.21 g/mol. IUPAC: (2,5-dioxopyrrolidin-1-yl) 1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylate;hydrochloride.
Chemical Property Profile of Difenoximide Hydrochloride
Property Insights of Difenoximide Hydrochloride
The XLogP value of 4.95 indicates that Difenoximide Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Difenoximide Hydrochloride. Following Lipinski's Rule of Five, Difenoximide Hydrochloride has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Difenoximide Hydrochloride?
The CAS number of Difenoximide Hydrochloride is 37800-79-6.
What is the molecular formula of Difenoximide Hydrochloride?
The molecular formula of Difenoximide Hydrochloride is C32H32ClN3O4.
What is the molecular weight of Difenoximide Hydrochloride?
The molecular weight of Difenoximide Hydrochloride is 557.21 g/mol.
Where can I buy Difenoximide Hydrochloride?
You can request a quote for Difenoximide Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Difenoximide Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Difenoximide Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.