ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate
TL;DR: ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate (CAS 385392-85-8) is a chemical compound with molecular formula C22H21BrN2O5 and molecular weight 472.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetyl]amino]benzoate
Also Known As: ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate, Ethyl 2-[[2-(3-bromo-6-methoxy-2-methyl-4-oxo-quinolin-1-yl)acetyl]amino]benzoate, ethyl 2-[[2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetyl]amino]benzoate, ethyl 2-{[(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetyl]amino}benzoate
| Molecular Formula | C22H21BrN2O5 |
|---|---|
| Molecular Weight | 472.06 g/mol |
| LogP | 3.89642 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 472.0634 |
| Heavy Atoms | 30 |
| Complexity | 1186.0968 |
Chemical Identifiers
| CAS Number | 385392-85-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CC=C1NC(=O)CN2C(=C(C(=O)C3=C2C=CC(=C3)OC)Br)C |
Product Overview
ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate (CAS 385392-85-8), with molecular formula C22H21BrN2O5 and molecular weight 472.06 g/mol. IUPAC: ethyl 2-[[2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetyl]amino]benzoate.
Chemical Property Profile of ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate
Property Insights of ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate
The XLogP value of 3.89642 indicates that ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate. Following Lipinski's Rule of Five, ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate 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 ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate?
The CAS number of ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate is 385392-85-8.
What is the molecular formula of ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate?
The molecular formula of ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate is C22H21BrN2O5.
What is the molecular weight of ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate?
The molecular weight of ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate is 472.06 g/mol.
Where can I buy ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate?
You can request a quote for ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-(2-(3-bromo-6-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.