3,5,7-Trimethyl-1H-indole-2-carboxylic acid
TL;DR: 3,5,7-Trimethyl-1H-indole-2-carboxylic acid (CAS 876715-82-1) 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.
3,5,7-trimethyl-1H-indole-2-carboxylic acid
Also Known As: 3,5,7-Trimethyl-1H-indole-2-carboxylic acid, 1334AF, BAS 10145053, 3,5,7-Trimethyl-1H-indole-2-carboxylicacid, 3,5,7-trimethylindole-2-carboxylic acid
| Molecular Formula | C12H13NO2 |
|---|---|
| Molecular Weight | 203.09 g/mol |
| LogP | 2.79136 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.09464 |
| Heavy Atoms | 15 |
| Complexity | 552.23773 |
Chemical Identifiers
| CAS Number | 876715-82-1 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)C(=C(N2)C(=O)O)C)C |
Product Overview
3,5,7-Trimethyl-1H-indole-2-carboxylic acid (CAS 876715-82-1), with molecular formula C12H13NO2 and molecular weight 203.09 g/mol. IUPAC: 3,5,7-trimethyl-1H-indole-2-carboxylic acid.
Chemical Property Profile of 3,5,7-Trimethyl-1H-indole-2-carboxylic acid
Property Insights of 3,5,7-Trimethyl-1H-indole-2-carboxylic acid
The XLogP value of 2.79136 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5,7-Trimethyl-1H-indole-2-carboxylic acid. With a topological polar surface area (TPSA) of 53.09 Ų, 3,5,7-Trimethyl-1H-indole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5,7-Trimethyl-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 3,5,7-Trimethyl-1H-indole-2-carboxylic acid?
The CAS number of 3,5,7-Trimethyl-1H-indole-2-carboxylic acid is 876715-82-1.
What is the molecular formula of 3,5,7-Trimethyl-1H-indole-2-carboxylic acid?
The molecular formula of 3,5,7-Trimethyl-1H-indole-2-carboxylic acid is C12H13NO2.
What is the molecular weight of 3,5,7-Trimethyl-1H-indole-2-carboxylic acid?
The molecular weight of 3,5,7-Trimethyl-1H-indole-2-carboxylic acid is 203.09 g/mol.
Where can I buy 3,5,7-Trimethyl-1H-indole-2-carboxylic acid?
You can request a quote for 3,5,7-Trimethyl-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 3,5,7-Trimethyl-1H-indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5,7-Trimethyl-1H-indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.