5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid
TL;DR: 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid (CAS 384363-85-3) is a chemical compound with molecular formula C19H17BrN2O6 and molecular weight 448.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-3-[(3,4,5-trimethoxybenzoyl)amino]-1H-indole-2-carboxylic acid
Also Known As: 5-bromo-3-[(3,4,5-trimethoxybenzoyl)amino]-1H-indole-2-carboxylic Acid, 5-BROMO-3-(3,4,5-TRIMETHOXYBENZAMIDO)-1H-INDOLE-2-CARBOXYLIC ACID, 5-bromo-3-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}-1H-indole-2-carboxylic acid
| Molecular Formula | C19H17BrN2O6 |
|---|---|
| Molecular Weight | 448.03 g/mol |
| LogP | 3.9067 |
| Topological Polar Surface Area | 109.88 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 448.027 |
| Heavy Atoms | 28 |
| Complexity | 1050.7114 |
Chemical Identifiers
| CAS Number | 384363-85-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NC2=C(NC3=C2C=C(C=C3)Br)C(=O)O |
Product Overview
5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid (CAS 384363-85-3), with molecular formula C19H17BrN2O6 and molecular weight 448.03 g/mol. IUPAC: 5-bromo-3-[(3,4,5-trimethoxybenzoyl)amino]-1H-indole-2-carboxylic acid.
Chemical Property Profile of 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid
Property Insights of 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid
The XLogP value of 3.9067 indicates that 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid. Following Lipinski's Rule of Five, 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid has 3 hydrogen bond donor(s) and 5 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-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid?
The CAS number of 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid is 384363-85-3.
What is the molecular formula of 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid?
The molecular formula of 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid is C19H17BrN2O6.
What is the molecular weight of 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid?
The molecular weight of 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid is 448.03 g/mol.
Where can I buy 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid?
You can request a quote for 5-Bromo-3-(3,4,5-trimethoxybenzamido)-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-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-3-(3,4,5-trimethoxybenzamido)-1H-indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.