4-Ethoxycarbonylphenoxy-2'-pyridylmethane
TL;DR: 4-Ethoxycarbonylphenoxy-2'-pyridylmethane (CAS 5452-66-4) is a chemical compound with molecular formula C15H15NO3 and molecular weight 257.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(pyridin-2-ylmethoxy)benzoate
Also Known As: ethyl 4-(pyridin-2-ylmethoxy)benzoate, 4-Ethoxycarbonylphenoxy-2'-pyridylmethane, Brl 10614, Benzoic acid, 4-(2-pyridinylmethoxy)-, ethyl ester, Ethyl 4-[(pyridin-2-yl)methoxy]benzoate
| Molecular Formula | C15H15NO3 |
|---|---|
| Molecular Weight | 257.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 48.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 257.1052 |
| Heavy Atoms | 19 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 5452-66-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)OCC2=CC=CC=N2 |
| InChIKey | OJWMBNSRBKSJIK-UHFFFAOYSA-N |
Product Overview
4-Ethoxycarbonylphenoxy-2'-pyridylmethane (CAS 5452-66-4), with molecular formula C15H15NO3 and molecular weight 257.11 g/mol. IUPAC: ethyl 4-(pyridin-2-ylmethoxy)benzoate.
Chemical Property Profile of 4-Ethoxycarbonylphenoxy-2'-pyridylmethane
Property Insights of 4-Ethoxycarbonylphenoxy-2'-pyridylmethane
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethoxycarbonylphenoxy-2'-pyridylmethane. With a topological polar surface area (TPSA) of 48.4 Ų, 4-Ethoxycarbonylphenoxy-2'-pyridylmethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethoxycarbonylphenoxy-2'-pyridylmethane has 0 hydrogen bond donor(s) and 4 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 4-Ethoxycarbonylphenoxy-2'-pyridylmethane?
The CAS number of 4-Ethoxycarbonylphenoxy-2'-pyridylmethane is 5452-66-4.
What is the molecular formula of 4-Ethoxycarbonylphenoxy-2'-pyridylmethane?
The molecular formula of 4-Ethoxycarbonylphenoxy-2'-pyridylmethane is C15H15NO3.
What is the molecular weight of 4-Ethoxycarbonylphenoxy-2'-pyridylmethane?
The molecular weight of 4-Ethoxycarbonylphenoxy-2'-pyridylmethane is 257.11 g/mol.
Where can I buy 4-Ethoxycarbonylphenoxy-2'-pyridylmethane?
You can request a quote for 4-Ethoxycarbonylphenoxy-2'-pyridylmethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethoxycarbonylphenoxy-2'-pyridylmethane?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethoxycarbonylphenoxy-2'-pyridylmethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.