![Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate structure](/static/products/314/314036-00-5.png)
Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate
TL;DR: Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate (CAS 314036-00-5) is a chemical compound with molecular formula C18H14N4O6 and molecular weight 382.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate
Also Known As: ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate, ethyl 4-((5,7-dinitroquinolin-8-yl)amino)benzoate, ethyl 4-({5,7-bisnitro-8-quinolinyl}amino)benzoate
| Molecular Formula | C18H14N4O6 |
|---|---|
| Molecular Weight | 382.09 g/mol |
| LogP | 3.9715 |
| Topological Polar Surface Area | 137.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.09134 |
| Heavy Atoms | 28 |
| Complexity | 1081.3761 |
Chemical Identifiers
| CAS Number | 314036-00-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC2=C(C=C(C3=C2N=CC=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate (CAS 314036-00-5), with molecular formula C18H14N4O6 and molecular weight 382.09 g/mol. IUPAC: ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate.
Chemical Property Profile of Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate
Property Insights of Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate
The XLogP value of 3.9715 indicates that Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 137.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate. Following Lipinski's Rule of Five, Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate has 1 hydrogen bond donor(s) and 8 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-[(5,7-dinitroquinolin-8-yl)amino]benzoate?
The CAS number of Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate is 314036-00-5.
What is the molecular formula of Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate?
The molecular formula of Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate is C18H14N4O6.
What is the molecular weight of Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate?
The molecular weight of Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate is 382.09 g/mol.
Where can I buy Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate?
You can request a quote for Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]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-[(5,7-dinitroquinolin-8-yl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.