![Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate structure](/static/products/5403/5403-23-6.webp)
Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate
TL;DR: Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate (CAS 5403-23-6) is a chemical compound with molecular formula C22H15BrN2O5 and molecular weight 466.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxo-1-pyridinyl]benzoate
Also Known As: AB00718511-01, T0516-7496, ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1-yl]benzoate, Ethyl 4-[5-(5-bromo-2-hydroxy-benzoyl)-3-cyano-2-oxo-pyridin-1-yl]benzoate, Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate
| Molecular Formula | C22H15BrN2O5 |
|---|---|
| Molecular Weight | 466.02 g/mol |
| LogP | 3.58498 |
| Topological Polar Surface Area | 109.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 466.01642 |
| Heavy Atoms | 30 |
| Complexity | 1239.8633 |
Chemical Identifiers
| CAS Number | 5403-23-6 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C=C(C=C(C2=O)C#N)C(=O)C3=C(C=CC(=C3)Br)O |
Product Overview
Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate (CAS 5403-23-6), with molecular formula C22H15BrN2O5 and molecular weight 466.02 g/mol. IUPAC: ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxo-1-pyridinyl]benzoate.
Chemical Property Profile of Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate
Property Insights of Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate
The XLogP value of 3.58498 indicates that Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate. Following Lipinski's Rule of Five, Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate has 1 hydrogen bond donor(s) and 6 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 Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate?
The CAS number of Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate is 5403-23-6.
What is the molecular formula of Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate?
The molecular formula of Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate is C22H15BrN2O5.
What is the molecular weight of Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate?
The molecular weight of Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate is 466.02 g/mol.
Where can I buy Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate?
You can request a quote for Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[5-(5-bromo-2-hydroxybenzoyl)-3-cyano-2-oxopyridin-1(2H)-yl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.