Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate
TL;DR: Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate (CAS 440090-40-4) is a chemical compound with molecular formula C21H20ClNO2 and molecular weight 353.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate
Also Known As: butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate, butyl 2-(4-chlorophenyl)-8-methyl-4-quinolinecarboxylate
| Molecular Formula | C21H20ClNO2 |
|---|---|
| Molecular Weight | 353.12 g/mol |
| LogP | 5.82052 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.11826 |
| Heavy Atoms | 25 |
| Complexity | 903.66315 |
Chemical Identifiers
| CAS Number | 440090-40-4 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC(=NC2=C(C=CC=C12)C)C3=CC=C(C=C3)Cl |
Product Overview
Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate (CAS 440090-40-4), with molecular formula C21H20ClNO2 and molecular weight 353.12 g/mol. IUPAC: butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate.
Chemical Property Profile of Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate
Property Insights of Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate
The XLogP value of 5.82052 indicates that Butyl 2-(4-chlorophenyl)-8-methylquinoline-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 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 2-(4-chlorophenyl)-8-methylquinoline-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 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate?
The CAS number of Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate is 440090-40-4.
What is the molecular formula of Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate?
The molecular formula of Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate is C21H20ClNO2.
What is the molecular weight of Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate?
The molecular weight of Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate is 353.12 g/mol.
Where can I buy Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate?
You can request a quote for Butyl 2-(4-chlorophenyl)-8-methylquinoline-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 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.