5,6,7-Trimethoxy-1H-indole-2-carboxylic acid
TL;DR: 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid (CAS 128781-07-7) is a chemical compound with molecular formula C12H13NO5 and molecular weight 251.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,7-trimethoxy-1H-indole-2-carboxylic acid
Also Known As: 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid, 1H-Indole-2-carboxylic acid, 5,6,7-trimethoxy-, ZERO/005664, 5,6,7-trimethoxyindole-2-carboxylic acid, BAS 10142221
| Molecular Formula | C12H13NO5 |
|---|---|
| Molecular Weight | 251.08 g/mol |
| LogP | 1.8919 |
| Topological Polar Surface Area | 80.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.07938 |
| Heavy Atoms | 18 |
| Complexity | 602.02386 |
Chemical Identifiers
| CAS Number | 128781-07-7 |
|---|---|
| SMILES | COC1=C(C(=C2C(=C1)C=C(N2)C(=O)O)OC)OC |
Product Overview
5,6,7-Trimethoxy-1H-indole-2-carboxylic acid (CAS 128781-07-7), with molecular formula C12H13NO5 and molecular weight 251.08 g/mol. IUPAC: 5,6,7-trimethoxy-1H-indole-2-carboxylic acid.
Chemical Property Profile of 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid
Property Insights of 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid
The XLogP value of 1.8919 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid. The TPSA of 80.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid. Following Lipinski's Rule of Five, 5,6,7-Trimethoxy-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 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid?
The CAS number of 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid is 128781-07-7.
What is the molecular formula of 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid?
The molecular formula of 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid is C12H13NO5.
What is the molecular weight of 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid?
The molecular weight of 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid is 251.08 g/mol.
Where can I buy 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid?
You can request a quote for 5,6,7-Trimethoxy-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 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5,6,7-Trimethoxy-1H-indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.