Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate
TL;DR: Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate (CAS 372979-07-2) is a chemical compound with molecular formula C18H22ClNO3 and molecular weight 335.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-chloro-1-hexyl-4-oxoquinoline-3-carboxylate
Also Known As: ethyl 7-chloro-1-hexyl-4-oxoquinoline-3-carboxylate, ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate, ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydro-3-quinolinecarboxylate
| Molecular Formula | C18H22ClNO3 |
|---|---|
| Molecular Weight | 335.13 g/mol |
| LogP | 4.4119 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 335.1288 |
| Heavy Atoms | 23 |
| Complexity | 751.7505 |
Chemical Identifiers
| CAS Number | 372979-07-2 |
|---|---|
| SMILES | CCCCCCN1C=C(C(=O)C2=C1C=C(C=C2)Cl)C(=O)OCC |
Product Overview
Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate (CAS 372979-07-2), with molecular formula C18H22ClNO3 and molecular weight 335.13 g/mol. IUPAC: ethyl 7-chloro-1-hexyl-4-oxoquinoline-3-carboxylate.
Chemical Property Profile of Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate
Property Insights of Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate
The XLogP value of 4.4119 indicates that Ethyl 7-chloro-1-hexyl-4-oxo-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 48.3 Ų, Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate has 0 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 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate?
The CAS number of Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate is 372979-07-2.
What is the molecular formula of Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate?
The molecular formula of Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate is C18H22ClNO3.
What is the molecular weight of Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate?
The molecular weight of Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate is 335.13 g/mol.
Where can I buy Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate?
You can request a quote for Ethyl 7-chloro-1-hexyl-4-oxo-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 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 7-chloro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.