Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate
TL;DR: Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate (CAS 355825-68-2) is a chemical compound with molecular formula C20H17BrClNO2 and molecular weight 417.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate
Also Known As: butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate, BUTYL 6-BROMO-2-(4-CHLOROPHENYL)-4-QUINOLINECARBOXYLATE
| Molecular Formula | C20H17BrClNO2 |
|---|---|
| Molecular Weight | 417.01 g/mol |
| LogP | 6.2746 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.01312 |
| Heavy Atoms | 25 |
| Complexity | 909.46326 |
Chemical Identifiers
| CAS Number | 355825-68-2 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3=CC=C(C=C3)Cl |
Product Overview
Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate (CAS 355825-68-2), with molecular formula C20H17BrClNO2 and molecular weight 417.01 g/mol. IUPAC: butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate.
Chemical Property Profile of Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate
Property Insights of Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate
The XLogP value of 6.2746 indicates that Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate?
The CAS number of Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate is 355825-68-2.
What is the molecular formula of Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate?
The molecular formula of Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate is C20H17BrClNO2.
What is the molecular weight of Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate?
The molecular weight of Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate is 417.01 g/mol.
Where can I buy Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate?
You can request a quote for Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.