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Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate
TL;DR: Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate (CAS 433973-27-4) is a chemical compound with molecular formula C20H17Cl2N3O3 and molecular weight 417.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-acetamidoanilino)-6,8-dichloroquinoline-3-carboxylate
Also Known As: ethyl 4-((4-acetamidophenyl)amino)-6,8-dichloroquinoline-3-carboxylate, ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate
| Molecular Formula | C20H17Cl2N3O3 |
|---|---|
| Molecular Weight | 417.06 g/mol |
| LogP | 5.4203 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.0647 |
| Heavy Atoms | 28 |
| Complexity | 1052.7405 |
Chemical Identifiers
| CAS Number | 433973-27-4 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C2C(=CC(=CC2=C1NC3=CC=C(C=C3)NC(=O)C)Cl)Cl |
Product Overview
Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate (CAS 433973-27-4), with molecular formula C20H17Cl2N3O3 and molecular weight 417.06 g/mol. IUPAC: ethyl 4-(4-acetamidoanilino)-6,8-dichloroquinoline-3-carboxylate.
Chemical Property Profile of Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate
Property Insights of Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate
The XLogP value of 5.4203 indicates that Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate has 2 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 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate?
The CAS number of Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate is 433973-27-4.
What is the molecular formula of Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate?
The molecular formula of Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate is C20H17Cl2N3O3.
What is the molecular weight of Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate?
The molecular weight of Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate is 417.06 g/mol.
Where can I buy Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate?
You can request a quote for Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-{[4-(acetylamino)phenyl]amino}-6,8-dichloroquinoline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.