![Diethyl 2-[2-(4-pyridyl)ethyl]malonate structure](/static/products/925/92501-98-9.png)
Diethyl 2-[2-(4-pyridyl)ethyl]malonate
TL;DR: Diethyl 2-[2-(4-pyridyl)ethyl]malonate (CAS 92501-98-9) is a chemical compound with molecular formula C14H19NO4 and molecular weight 265.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(2-pyridin-4-ylethyl)propanedioate
Also Known As: Tirofiban Impurity 36, diethyl 2-[2-(4-pyridyl)ethyl]malonate, diethyl 2-(2-pyridin-4-ylethyl)propanedioate, diethyl 2-(pyridin-4-yl)ethylmalonate, diethyl beta-(4-pyridyl)-ethylmalonate
| Molecular Formula | C14H19NO4 |
|---|---|
| Molecular Weight | 265.13 g/mol |
| LogP | 1.7566 |
| Topological Polar Surface Area | 65.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 265.1314 |
| Heavy Atoms | 19 |
| Complexity | 387.1668 |
Chemical Identifiers
| CAS Number | 92501-98-9 |
|---|---|
| SMILES | CCOC(=O)C(CCC1=CC=NC=C1)C(=O)OCC |
Product Overview
Diethyl 2-[2-(4-pyridyl)ethyl]malonate (CAS 92501-98-9), with molecular formula C14H19NO4 and molecular weight 265.13 g/mol. IUPAC: diethyl 2-(2-pyridin-4-ylethyl)propanedioate.
Chemical Property Profile of Diethyl 2-[2-(4-pyridyl)ethyl]malonate
Property Insights of Diethyl 2-[2-(4-pyridyl)ethyl]malonate
The XLogP value of 1.7566 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-[2-(4-pyridyl)ethyl]malonate. The TPSA of 65.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-[2-(4-pyridyl)ethyl]malonate. Following Lipinski's Rule of Five, Diethyl 2-[2-(4-pyridyl)ethyl]malonate has 0 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 Diethyl 2-[2-(4-pyridyl)ethyl]malonate?
The CAS number of Diethyl 2-[2-(4-pyridyl)ethyl]malonate is 92501-98-9.
What is the molecular formula of Diethyl 2-[2-(4-pyridyl)ethyl]malonate?
The molecular formula of Diethyl 2-[2-(4-pyridyl)ethyl]malonate is C14H19NO4.
What is the molecular weight of Diethyl 2-[2-(4-pyridyl)ethyl]malonate?
The molecular weight of Diethyl 2-[2-(4-pyridyl)ethyl]malonate is 265.13 g/mol.
Where can I buy Diethyl 2-[2-(4-pyridyl)ethyl]malonate?
You can request a quote for Diethyl 2-[2-(4-pyridyl)ethyl]malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-[2-(4-pyridyl)ethyl]malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[2-(4-pyridyl)ethyl]malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.