4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid
TL;DR: 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid (CAS 881041-58-3) is a chemical compound with molecular formula C12H12BrNO4 and molecular weight 312.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic acid
Also Known As: 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid, AB01279749-01, 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylicAcid
| Molecular Formula | C12H12BrNO4 |
|---|---|
| Molecular Weight | 312.99 g/mol |
| LogP | 3.0359 |
| Topological Polar Surface Area | 71.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.99496 |
| Heavy Atoms | 18 |
| Complexity | 605.6335 |
Chemical Identifiers
| CAS Number | 881041-58-3 |
|---|---|
| SMILES | CCOC1=C2C(=C(C=C1OC)Br)C=C(N2)C(=O)O |
Product Overview
4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid (CAS 881041-58-3), with molecular formula C12H12BrNO4 and molecular weight 312.99 g/mol. IUPAC: 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic acid.
Chemical Property Profile of 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid
Property Insights of 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid
The XLogP value of 3.0359 indicates that 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid. Following Lipinski's Rule of Five, 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid has 2 hydrogen bond donor(s) and 3 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 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid?
The CAS number of 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid is 881041-58-3.
What is the molecular formula of 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid?
The molecular formula of 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid is C12H12BrNO4.
What is the molecular weight of 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid?
The molecular weight of 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid is 312.99 g/mol.
Where can I buy 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid?
You can request a quote for 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-7-ethoxy-6-methoxy-1H-indole-2-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.