6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide
TL;DR: 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide (CAS 445016-46-6) is a chemical compound with molecular formula C21H16BrN3O2 and molecular weight 421.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-(4-methylphenyl)quinoline-4-carboxamide
Also Known As: 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-(4-methylphenyl)quinoline-4-carboxamide, 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide, [6-bromo-2-(4-methylphenyl)(4-quinolyl)]-N-(5-methylisoxazol-3-yl)carboxamide
| Molecular Formula | C21H16BrN3O2 |
|---|---|
| Molecular Weight | 421.04 g/mol |
| LogP | 5.52144 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.0426 |
| Heavy Atoms | 27 |
| Complexity | 1150.0255 |
Chemical Identifiers
| CAS Number | 445016-46-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=NOC(=C4)C |
Product Overview
6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide (CAS 445016-46-6), with molecular formula C21H16BrN3O2 and molecular weight 421.04 g/mol. IUPAC: 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-(4-methylphenyl)quinoline-4-carboxamide.
Chemical Property Profile of 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide
Property Insights of 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide
The XLogP value of 5.52144 indicates that 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide. Following Lipinski's Rule of Five, 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide 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 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide?
The CAS number of 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide is 445016-46-6.
What is the molecular formula of 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide?
The molecular formula of 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide is C21H16BrN3O2.
What is the molecular weight of 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide?
The molecular weight of 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide is 421.04 g/mol.
Where can I buy 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide?
You can request a quote for 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 6-bromo-N-(5-methyl-3-isoxazolyl)-2-(4-methylphenyl)-4-quinolinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.