2-Ethyl-3-methyl-1H-indole-5-carboxylic acid
TL;DR: 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid (CAS 197305-97-8) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-3-methyl-1H-indole-5-carboxylic acid
Also Known As: 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid, BAS 10143758, 2-ethyl-3-methyl-5-indolecarboxylic acid, 2-ethyl-3-methylindole-5-carboxylic acid, 2-Hydrazino-4-(trifluoromethyl)pyrimidine
| Molecular Formula | C12H13NO2 |
|---|---|
| Molecular Weight | 203.09 g/mol |
| LogP | 2.73692 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.09464 |
| Heavy Atoms | 15 |
| Complexity | 525.6468 |
Chemical Identifiers
| CAS Number | 197305-97-8 |
|---|---|
| SMILES | CCC1=C(C2=C(N1)C=CC(=C2)C(=O)O)C |
Product Overview
2-Ethyl-3-methyl-1H-indole-5-carboxylic acid (CAS 197305-97-8), with molecular formula C12H13NO2 and molecular weight 203.09 g/mol. IUPAC: 2-ethyl-3-methyl-1H-indole-5-carboxylic acid.
Chemical Property Profile of 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid
Property Insights of 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid
The XLogP value of 2.73692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid. With a topological polar surface area (TPSA) of 53.09 Ų, 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-3-methyl-1H-indole-5-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 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid?
The CAS number of 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid is 197305-97-8.
What is the molecular formula of 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid?
The molecular formula of 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid is C12H13NO2.
What is the molecular weight of 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid?
The molecular weight of 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid is 203.09 g/mol.
Where can I buy 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid?
You can request a quote for 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-3-methyl-1H-indole-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.