4,7-Dimethoxy-1H-indole-2-carboxylic acid
TL;DR: 4,7-Dimethoxy-1H-indole-2-carboxylic acid (CAS 31271-83-7) is a chemical compound with molecular formula C11H11NO4 and molecular weight 221.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7-dimethoxy-1H-indole-2-carboxylic acid
Also Known As: 4,7-Dimethoxy-1H-indole-2-carboxylic acid, 4,7-dimethoxyindole-2-carboxylic acid, ZERO/005682, 1H-Indole-2-carboxylic acid, 4,7-dimethoxy-, 4,7-Dimethoxy-1H-indole-2-carboxylicacid
| Molecular Formula | C11H11NO4 |
|---|---|
| Molecular Weight | 221.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 71.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.0688 |
| Heavy Atoms | 16 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 31271-83-7 |
|---|---|
| SMILES | COC1=C2C=C(NC2=C(C=C1)OC)C(=O)O |
| InChIKey | FJWNGDWJFIQNEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,7-Dimethoxy-1H-indole-2-carboxylic acid (CAS 31271-83-7), with molecular formula C11H11NO4 and molecular weight 221.07 g/mol. IUPAC: 4,7-dimethoxy-1H-indole-2-carboxylic acid.
Chemical Property Profile of 4,7-Dimethoxy-1H-indole-2-carboxylic acid
Property Insights of 4,7-Dimethoxy-1H-indole-2-carboxylic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,7-Dimethoxy-1H-indole-2-carboxylic acid. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,7-Dimethoxy-1H-indole-2-carboxylic acid. Following Lipinski's Rule of Five, 4,7-Dimethoxy-1H-indole-2-carboxylic acid has 2 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 4,7-Dimethoxy-1H-indole-2-carboxylic acid?
The CAS number of 4,7-Dimethoxy-1H-indole-2-carboxylic acid is 31271-83-7.
What is the molecular formula of 4,7-Dimethoxy-1H-indole-2-carboxylic acid?
The molecular formula of 4,7-Dimethoxy-1H-indole-2-carboxylic acid is C11H11NO4.
What is the molecular weight of 4,7-Dimethoxy-1H-indole-2-carboxylic acid?
The molecular weight of 4,7-Dimethoxy-1H-indole-2-carboxylic acid is 221.07 g/mol.
Where can I buy 4,7-Dimethoxy-1H-indole-2-carboxylic acid?
You can request a quote for 4,7-Dimethoxy-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 4,7-Dimethoxy-1H-indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,7-Dimethoxy-1H-indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.