![Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate structure](/static/products/5225/522594-68-9.webp)
Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate
TL;DR: Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate (CAS 522594-68-9) is a chemical compound with molecular formula C27H18BrN3O3S and molecular weight 543.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(6-bromo-2-phenylquinoline-4-carbonyl)amino]-4-pyridin-3-ylthiophene-3-carboxylate
Also Known As: Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate, methyl 2-[(6-bromo-2-phenylquinoline-4-carbonyl)amino]-4-pyridin-3-ylthiophene-3-carboxylate, methyl 2-{[(6-bromo-2-phenylquinolin-4-yl)carbonyl]amino}-4-(pyridin-3-yl)thiophene-3-carboxylate, methyl 2-[(6-bromo-2-phenyl(4-quinolyl))carbonylamino]-4-(3-pyridyl)thiophene- 3-carboxylate, Methyl 2-[(6-bromo-2-phenyl-quinoline-4-carbonyl)amino]-4-pyridin-3-yl-thiophene-3-carboxylate
| Molecular Formula | C27H18BrN3O3S |
|---|---|
| Molecular Weight | 543.03 g/mol |
| LogP | 6.8267 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 543.0252 |
| Heavy Atoms | 35 |
| Complexity | 1552.8169 |
Chemical Identifiers
| CAS Number | 522594-68-9 |
|---|---|
| SMILES | COC(=O)C1=C(SC=C1C2=CN=CC=C2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5 |
Product Overview
Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate (CAS 522594-68-9), with molecular formula C27H18BrN3O3S and molecular weight 543.03 g/mol. IUPAC: methyl 2-[(6-bromo-2-phenylquinoline-4-carbonyl)amino]-4-pyridin-3-ylthiophene-3-carboxylate.
Chemical Property Profile of Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate
Property Insights of Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate
The XLogP value of 6.8267 indicates that Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate. Following Lipinski's Rule of Five, Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate?
The CAS number of Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate is 522594-68-9.
What is the molecular formula of Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate?
The molecular formula of Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate is C27H18BrN3O3S.
What is the molecular weight of Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate?
The molecular weight of Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate is 543.03 g/mol.
Where can I buy Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate?
You can request a quote for Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[[(6-bromo-2-phenyl-4-quinolinyl)carbonyl]amino]-4-(3-pyridinyl)-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.