2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride
TL;DR: 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride (CAS 2596-90-9) is a chemical compound with molecular formula C19H26Cl2N2O3 and molecular weight 400.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 2-hydroxy-2-phenyl-2-pyridin-3-ylacetate;dihydrochloride
Also Known As: 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride, 3-Pyridineglycolic acid, alpha-phenyl-, 2-(diethylamino)ethyl ester, dihydrochloride, 2-(diethylamino)ethyl hydroxy(phenyl)pyridin-3-ylacetate dihydrochloride, 2-(Diethylamino)ethyl hydroxy(phenyl)(pyridin-3-yl)acetate--hydrogen chloride (1/2), N'-{[5-(4-nitrophenyl)furan-2-yl]methylene}pyridine-4-carbohydrazide
| Molecular Formula | C19H26Cl2N2O3 |
|---|---|
| Molecular Weight | 400.13 g/mol |
| LogP | 3.0461 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 400.13205 |
| Heavy Atoms | 26 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 2596-90-9 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CN=CC=C2)O.Cl.Cl |
| InChIKey | XPHZIQHCMAZCRK-UHFFFAOYSA-N |
Product Overview
2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride (CAS 2596-90-9), with molecular formula C19H26Cl2N2O3 and molecular weight 400.13 g/mol. IUPAC: 2-(diethylamino)ethyl 2-hydroxy-2-phenyl-2-pyridin-3-ylacetate;dihydrochloride.
Chemical Property Profile of 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride
Property Insights of 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride
The XLogP value of 3.0461 indicates that 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride. Following Lipinski's Rule of Five, 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride has 3 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 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride?
The CAS number of 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride is 2596-90-9.
What is the molecular formula of 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride?
The molecular formula of 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride is C19H26Cl2N2O3.
What is the molecular weight of 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride?
The molecular weight of 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride is 400.13 g/mol.
Where can I buy 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride?
You can request a quote for 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diethylamino)ethyl alpha-phenyl-3-pyridineglycolate dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.