Aprolidine
TL;DR: Aprolidine (CAS 4775-90-0) is a chemical compound with molecular formula C22H25NO2 and molecular weight 335.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azabicyclo[2.2.2]octan-3-yl 2,2-diphenylpropanoate
Also Known As: Aprolidine, 3-Qdpp, 3-Quinuclidinyl 2,2-diphenylpropanoate, 2,2-Diphenylpropanoic acid 3-quinuclidinyl ester, 1-azabicyclo[2.2.2]octan-3-yl 2,2-diphenylpropanoate
| Molecular Formula | C22H25NO2 |
|---|---|
| Molecular Weight | 335.19 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.18854 |
| Heavy Atoms | 25 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 4775-90-0 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC3CN4CCC3CC4 |
| InChIKey | WOPPGGGGQFNBFL-UHFFFAOYSA-N |
Product Overview
Aprolidine (CAS 4775-90-0), with molecular formula C22H25NO2 and molecular weight 335.19 g/mol. IUPAC: 1-azabicyclo[2.2.2]octan-3-yl 2,2-diphenylpropanoate.
Chemical Property Profile of Aprolidine
Property Insights of Aprolidine
The XLogP value of 4.4 indicates that Aprolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Aprolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aprolidine 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 Aprolidine?
The CAS number of Aprolidine is 4775-90-0.
What is the molecular formula of Aprolidine?
The molecular formula of Aprolidine is C22H25NO2.
What is the molecular weight of Aprolidine?
The molecular weight of Aprolidine is 335.19 g/mol.
Where can I buy Aprolidine?
You can request a quote for Aprolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aprolidine?
Yes, KEHONG BIO provides custom synthesis services for Aprolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.