![5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid structure](/static/products/6887/688748-24-5.webp)
5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid
TL;DR: 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid (CAS 688748-24-5) is a chemical compound with molecular formula C17H12ClFN2O3 and molecular weight 346.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-[2-(4-fluoroanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid
Also Known As: 5-chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid, 5-chloro-3-[(4-fluorophenyl)carbamoylmethyl]-1H-indole-2-carboxylic Acid, 5-chloro-3-[2-(4-fluoroanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid
| Molecular Formula | C17H12ClFN2O3 |
|---|---|
| Molecular Weight | 346.05 g/mol |
| LogP | 3.8398 |
| Topological Polar Surface Area | 82.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.05206 |
| Heavy Atoms | 24 |
| Complexity | 934.9087 |
Chemical Identifiers
| CAS Number | 688748-24-5 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O)F |
Product Overview
5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid (CAS 688748-24-5), with molecular formula C17H12ClFN2O3 and molecular weight 346.05 g/mol. IUPAC: 5-chloro-3-[2-(4-fluoroanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid.
Chemical Property Profile of 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid
Property Insights of 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid
The XLogP value of 3.8398 indicates that 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid. Following Lipinski's Rule of Five, 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid has 3 hydrogen bond donor(s) and 2 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-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid?
The CAS number of 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid is 688748-24-5.
What is the molecular formula of 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid?
The molecular formula of 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid is C17H12ClFN2O3.
What is the molecular weight of 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid?
The molecular weight of 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid is 346.05 g/mol.
Where can I buy 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid?
You can request a quote for 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-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-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-3-[(4-fluoro-phenylcarbamoyl)-methyl]-1h-indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.