布奎那类似物
TL;DR: 布奎那类似物 (CAS 96187-27-8) is a chemical compound with molecular formula C23H16FNO2 and molecular weight 357.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
布奎那类似物
6-fluoro-3-methyl-2-(4-phenylphenyl)quinoline-4-carboxylic acid
Also Known As: BREQUINAR ANALOG, 2-biphenyl-4-yl-6-fluoro-3-methyl-quinoline-4-carboxylic acid, 6-fluoro-3-methyl-2-(4-phenylphenyl)quinoline-4-carboxylic acid, 2-(4-biphenylyl)-6-fluoro-3-methylquinoline-4-carboxylic acid, 2-biphenyl-4-yl-6-fluoro-3-methyl-quinoline-4 carboxylic acid
| Molecular Formula | C23H16FNO2 |
|---|---|
| Molecular Weight | 357.12 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.11652 |
| Heavy Atoms | 27 |
| Complexity | 513.0 |
Chemical Identifiers
| CAS Number | 96187-27-8 |
|---|---|
| SMILES | CC1=C(C2=C(C=CC(=C2)F)N=C1C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O |
| InChIKey | WYKKHJQZENLZID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
布奎那类似物 (CAS 96187-27-8), with molecular formula C23H16FNO2 and molecular weight 357.12 g/mol. IUPAC: 6-fluoro-3-methyl-2-(4-phenylphenyl)quinoline-4-carboxylic acid.
Chemical Property Profile of 布奎那类似物
Property Insights of 布奎那类似物
The XLogP value of 5.5 indicates that 布奎那类似物 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 布奎那类似物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 布奎那类似物 has 1 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 布奎那类似物?
The CAS number of 布奎那类似物 is 96187-27-8.
What is the molecular formula of 布奎那类似物?
The molecular formula of 布奎那类似物 is C23H16FNO2.
What is the molecular weight of 布奎那类似物?
The molecular weight of 布奎那类似物 is 357.12 g/mol.
Where can I buy 布奎那类似物?
You can request a quote for 布奎那类似物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 布奎那类似物?
Yes, KEHONG BIO provides custom synthesis services for 布奎那类似物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.