Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate
TL;DR: Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate (CAS 544463-86-7) is a chemical compound with molecular formula C25H20N2O6 and molecular weight 444.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-[[2-(5-methylfuran-2-yl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate
Also Known As: dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate, dimethyl 5-[[2-(5-methylfuran-2-yl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate, dimethyl 5-(2-(5-methylfuran-2-yl)quinoline-4-carboxamido)isophthalate, DIMETHYL 5-({[2-(5-METHYL-2-FURYL)-4-QUINOLYL]CARBONYL}AMINO)ISOPHTHALATE, dimethyl 5-({[2-(5-methylfuran-2-yl)quinolin-4-yl]carbonyl}amino)benzene-1,3-dicarboxylate
| Molecular Formula | C25H20N2O6 |
|---|---|
| Molecular Weight | 444.13 g/mol |
| LogP | 4.62872 |
| Topological Polar Surface Area | 107.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 444.13214 |
| Heavy Atoms | 33 |
| Complexity | 1354.6836 |
Chemical Identifiers
| CAS Number | 544463-86-7 |
|---|---|
| SMILES | CC1=CC=C(O1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC(=C4)C(=O)OC)C(=O)OC |
Product Overview
Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate (CAS 544463-86-7), with molecular formula C25H20N2O6 and molecular weight 444.13 g/mol. IUPAC: dimethyl 5-[[2-(5-methylfuran-2-yl)quinoline-4-carbonyl]amino]benzene-1,3-dicarboxylate.
Chemical Property Profile of Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate
Property Insights of Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate
The XLogP value of 4.62872 indicates that Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate. Following Lipinski's Rule of Five, Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The CAS number of Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate is 544463-86-7.
What is the molecular formula of Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The molecular formula of Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate is C25H20N2O6.
What is the molecular weight of Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate?
The molecular weight of Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate is 444.13 g/mol.
Where can I buy Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate?
You can request a quote for Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 5-({[2-(5-methyl-2-furyl)-4-quinolinyl]carbonyl}amino)isophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.