Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate
TL;DR: Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate (CAS 79660-64-3) is a chemical compound with molecular formula C12H10ClF2NO2 and molecular weight 273.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate
Also Known As: ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate, 3-Quinolinecarboxylic acid, 4-chloro-6,8-difluoro-1,4-dihydro-, ethyl ester, 4-CHLORO-6,8-DIFLUORO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC ACID ETHYL ESTER, Ethyl 4-chloro-6,8-difluoro-1,4-dihydro-3-quinolinecarboxylate
| Molecular Formula | C12H10ClF2NO2 |
|---|---|
| Molecular Weight | 273.04 g/mol |
| LogP | 3.1172 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.0368 |
| Heavy Atoms | 18 |
| Complexity | 531.05383 |
Chemical Identifiers
| CAS Number | 79660-64-3 |
|---|---|
| SMILES | CCOC(=O)C1=CNC2=C(C1Cl)C=C(C=C2F)F |
Product Overview
Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate (CAS 79660-64-3), with molecular formula C12H10ClF2NO2 and molecular weight 273.04 g/mol. IUPAC: ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate.
Chemical Property Profile of Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate
Property Insights of Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate
The XLogP value of 3.1172 indicates that Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate has 1 hydrogen bond donor(s) and 3 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-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate?
The CAS number of Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate is 79660-64-3.
What is the molecular formula of Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate?
The molecular formula of Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate is C12H10ClF2NO2.
What is the molecular weight of Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate?
The molecular weight of Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate is 273.04 g/mol.
Where can I buy Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate?
You can request a quote for Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-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-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-chloro-6,8-difluoro-1,4-dihydroquinoline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.