1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid
TL;DR: 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid (CAS 17826-25-4) is a chemical compound with molecular formula C15H19NO3 and molecular weight 261.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-5-methoxy-2-methylindole-3-carboxylic acid
Also Known As: SDCCGSBI-0661828.P001, 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid, AE-848/11486052, 1-butyl-5-methoxy-2-methylindole-3-carboxylic acid
| Molecular Formula | C15H19NO3 |
|---|---|
| Molecular Weight | 261.14 g/mol |
| LogP | 3.45662 |
| Topological Polar Surface Area | 51.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.1365 |
| Heavy Atoms | 19 |
| Complexity | 613.36847 |
Chemical Identifiers
| CAS Number | 17826-25-4 |
|---|---|
| SMILES | CCCCN1C(=C(C2=C1C=CC(=C2)OC)C(=O)O)C |
Product Overview
1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid (CAS 17826-25-4), with molecular formula C15H19NO3 and molecular weight 261.14 g/mol. IUPAC: 1-butyl-5-methoxy-2-methylindole-3-carboxylic acid.
Chemical Property Profile of 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid
Property Insights of 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid
The XLogP value of 3.45662 indicates that 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.46 Ų, 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid has 1 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 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid?
The CAS number of 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid is 17826-25-4.
What is the molecular formula of 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid?
The molecular formula of 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid is C15H19NO3.
What is the molecular weight of 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid?
The molecular weight of 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid is 261.14 g/mol.
Where can I buy 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid?
You can request a quote for 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-butyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.