Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate
TL;DR: Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate (CAS 449180-22-7) is a chemical compound with molecular formula C19H17ClN2O2 and molecular weight 340.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(3-chloro-2-methylanilino)quinoline-3-carboxylate
Also Known As: ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate, AP-906/41249865, ethyl 4-(3-chloro-2-methylanilino)quinoline-3-carboxylate, ethyl 4-[(3-chloro-2-methylphenyl)amino]quinoline-3-carboxylate
| Molecular Formula | C19H17ClN2O2 |
|---|---|
| Molecular Weight | 340.10 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.09787 |
| Heavy Atoms | 24 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 449180-22-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=CC=CC=C2N=C1)NC3=C(C(=CC=C3)Cl)C |
| InChIKey | DKVPDVJTIJZRBH-UHFFFAOYSA-N |
Product Overview
Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate (CAS 449180-22-7), with molecular formula C19H17ClN2O2 and molecular weight 340.10 g/mol. IUPAC: ethyl 4-(3-chloro-2-methylanilino)quinoline-3-carboxylate.
Chemical Property Profile of Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate
Property Insights of Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate
The XLogP value of 5.5 indicates that Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate has 1 hydrogen bond donor(s) and 4 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-(3-chloro-2-methylanilino)-3-quinolinecarboxylate?
The CAS number of Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate is 449180-22-7.
What is the molecular formula of Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate?
The molecular formula of Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate is C19H17ClN2O2.
What is the molecular weight of Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate?
The molecular weight of Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate is 340.10 g/mol.
Where can I buy Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate?
You can request a quote for Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(3-chloro-2-methylanilino)-3-quinolinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.