Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate
TL;DR: Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate (CAS 355419-80-6) is a chemical compound with molecular formula C21H20BrNO3 and molecular weight 413.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 6-bromo-2-(4-methoxyphenyl)quinoline-4-carboxylate
Also Known As: butyl 6-bromo-2-(4-methoxyphenyl)quinoline-4-carboxylate, butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate, UPCMLD0ENAT5689745:001, 632-122-0
| Molecular Formula | C21H20BrNO3 |
|---|---|
| Molecular Weight | 413.06 g/mol |
| LogP | 5.6298 |
| Topological Polar Surface Area | 48.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.06265 |
| Heavy Atoms | 26 |
| Complexity | 922.43756 |
Chemical Identifiers
| CAS Number | 355419-80-6 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3=CC=C(C=C3)OC |
Product Overview
Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate (CAS 355419-80-6), with molecular formula C21H20BrNO3 and molecular weight 413.06 g/mol. IUPAC: butyl 6-bromo-2-(4-methoxyphenyl)quinoline-4-carboxylate.
Chemical Property Profile of Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate
Property Insights of Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate
The XLogP value of 5.6298 indicates that Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.42 Ų, Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate has 0 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 Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate?
The CAS number of Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate is 355419-80-6.
What is the molecular formula of Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate?
The molecular formula of Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate is C21H20BrNO3.
What is the molecular weight of Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate?
The molecular weight of Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate is 413.06 g/mol.
Where can I buy Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate?
You can request a quote for Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate 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-methoxyphenyl)-4-quinolinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 6-bromo-2-(4-methoxyphenyl)-4-quinolinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.