5-Fluoro-3-methyl-1H-indole-2-carboxylic acid
TL;DR: 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (CAS 16381-46-7) is a chemical compound with molecular formula C10H8FNO2 and molecular weight 193.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoro-3-methyl-1H-indole-2-carboxylic acid
Also Known As: 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid, 5-Fluoro-3-methyl-2-indolic acid, 1H-Indole-2-carboxylic acid, 5-fluoro-3-methyl-, 5H-Dibenzo[b,e]azepine-6,11-dione, BAS 10145256
| Molecular Formula | C10H8FNO2 |
|---|---|
| Molecular Weight | 193.05 g/mol |
| LogP | 2.31362 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.05391 |
| Heavy Atoms | 14 |
| Complexity | 516.0615 |
Chemical Identifiers
| CAS Number | 16381-46-7 |
|---|---|
| SMILES | CC1=C(NC2=C1C=C(C=C2)F)C(=O)O |
Product Overview
5-Fluoro-3-methyl-1H-indole-2-carboxylic acid (CAS 16381-46-7), with molecular formula C10H8FNO2 and molecular weight 193.05 g/mol. IUPAC: 5-fluoro-3-methyl-1H-indole-2-carboxylic acid.
Chemical Property Profile of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid
Property Insights of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid
The XLogP value of 2.31362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid. With a topological polar surface area (TPSA) of 53.09 Ų, 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid has 2 hydrogen bond donor(s) and 1 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-Fluoro-3-methyl-1H-indole-2-carboxylic acid?
The CAS number of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid is 16381-46-7.
What is the molecular formula of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid?
The molecular formula of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid is C10H8FNO2.
What is the molecular weight of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid?
The molecular weight of 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid is 193.05 g/mol.
Where can I buy 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid?
You can request a quote for 5-Fluoro-3-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-Fluoro-3-methyl-1H-indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Fluoro-3-methyl-1H-indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.