Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate
TL;DR: Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate (CAS 495406-67-2) is a chemical compound with molecular formula C12H10BrNO4 and molecular weight 310.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-bromo-8-methoxy-4-oxo-1H-quinoline-2-carboxylate
Also Known As: methyl 4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylat, Methyl 5-bromo-8-methoxy-4-oxo-1H-quinoline-2-carboxylate, Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate
| Molecular Formula | C12H10BrNO4 |
|---|---|
| Molecular Weight | 310.98 g/mol |
| LogP | 2.0858 |
| Topological Polar Surface Area | 68.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 310.9793 |
| Heavy Atoms | 18 |
| Complexity | 677.56714 |
Chemical Identifiers
| CAS Number | 495406-67-2 |
|---|---|
| SMILES | COC1=C2C(=C(C=C1)Br)C(=O)C=C(N2)C(=O)OC |
Product Overview
Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate (CAS 495406-67-2), with molecular formula C12H10BrNO4 and molecular weight 310.98 g/mol. IUPAC: methyl 5-bromo-8-methoxy-4-oxo-1H-quinoline-2-carboxylate.
Chemical Property Profile of Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate
Property Insights of Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate
The XLogP value of 2.0858 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate. The TPSA of 68.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate. Following Lipinski's Rule of Five, Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate has 1 hydrogen bond donor(s) and 4 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 Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate?
The CAS number of Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate is 495406-67-2.
What is the molecular formula of Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate?
The molecular formula of Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate is C12H10BrNO4.
What is the molecular weight of Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate?
The molecular weight of Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate is 310.98 g/mol.
Where can I buy Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate?
You can request a quote for Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl-4-hydroxy-5-bromo-8-methoxy-quinoline-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.