Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride
TL;DR: Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride (CAS 474002-28-3) is a chemical compound with molecular formula C23H19Cl2N3O2 and molecular weight 439.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]benzoate;hydrochloride
Also Known As: Ethyl 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]benzoate Hydrochloride, ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride, ethyl 3-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}benzoate, chloride
| Molecular Formula | C23H19Cl2N3O2 |
|---|---|
| Molecular Weight | 439.09 g/mol |
| LogP | 6.2923 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.08542 |
| Heavy Atoms | 30 |
| Complexity | 1180.657 |
Chemical Identifiers
| CAS Number | 474002-28-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl.Cl |
Product Overview
Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride (CAS 474002-28-3), with molecular formula C23H19Cl2N3O2 and molecular weight 439.09 g/mol. IUPAC: ethyl 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]benzoate;hydrochloride.
Chemical Property Profile of Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride
Property Insights of Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride
The XLogP value of 6.2923 indicates that Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride. Following Lipinski's Rule of Five, Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride?
The CAS number of Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride is 474002-28-3.
What is the molecular formula of Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride?
The molecular formula of Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride is C23H19Cl2N3O2.
What is the molecular weight of Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride?
The molecular weight of Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride is 439.09 g/mol.
Where can I buy Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride?
You can request a quote for Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-((2-(4-chlorophenyl)quinazolin-4-yl)amino)benzoate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.