3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester
TL;DR: 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester (CAS 74037-37-9) is a chemical compound with molecular formula C20H22N2O3 and molecular weight 338.16 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-hydroxy-2-phenyl-2-pyridin-3-ylacetate
Also Known As: 3-Quinuclidinol, 2-hydroxy-2-phenyl-2-(3-pyridyl)acetate (ester), 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester, 3-Quinuclidinyl=alpha-hydroxy-alpha-phenyl-3-pyridineacetate, 1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-2-phenyl-2-pyridin-3-ylacetate, 1-Azabicyclo[2.2.2]octan-3-yl hydroxy(phenyl)(pyridin-3-yl)acetate
| Molecular Formula | C20H22N2O3 |
|---|---|
| Molecular Weight | 338.16 g/mol |
| LogP | 1.9549 |
| Topological Polar Surface Area | 62.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.16306 |
| Heavy Atoms | 25 |
| Complexity | 687.6212 |
Chemical Identifiers
| CAS Number | 74037-37-9 |
|---|---|
| SMILES | C1CN2CCC1C(C2)OC(=O)C(C3=CC=CC=C3)(C4=CN=CC=C4)O |
Product Overview
3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester (CAS 74037-37-9), with molecular formula C20H22N2O3 and molecular weight 338.16 g/mol. IUPAC: 1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-2-phenyl-2-pyridin-3-ylacetate.
Chemical Property Profile of 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester
Property Insights of 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester
The XLogP value of 1.9549 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester. The TPSA of 62.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester. Following Lipinski's Rule of Five, 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester has 1 hydrogen bond donor(s) and 5 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 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester?
The CAS number of 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester is 74037-37-9.
What is the molecular formula of 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester?
The molecular formula of 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester is C20H22N2O3.
What is the molecular weight of 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester?
The molecular weight of 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester is 338.16 g/mol.
Where can I buy 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester?
You can request a quote for 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridineacetic acid, alpha-hydroxy-alpha-phenyl-, 3-quinuclidinyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.