3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid
TL;DR: 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid (CAS 2245-75-2) is a chemical compound with molecular formula C13H16N2O2 and molecular weight 232.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid
Also Known As: 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid, 5,7-Dimethyltryptamin-2-carbonsaeure, 3-(2-aminoethyl)-5,7-dimethylindole-2-carboxylic acid, Indole-2-carboxylic acid, 3-(2-aminoethyl)-5,7-dimethyl-, 1H-Indole-2-carboxylic acid, 3-(2-aminoethyl)-5,7-dimethyl-
| Molecular Formula | C13H16N2O2 |
|---|---|
| Molecular Weight | 232.12 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 79.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.12119 |
| Heavy Atoms | 17 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 2245-75-2 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)C(=C(N2)C(=O)O)CCN)C |
| InChIKey | JJPBBLYMQPFDKW-UHFFFAOYSA-N |
Product Overview
3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid (CAS 2245-75-2), with molecular formula C13H16N2O2 and molecular weight 232.12 g/mol. IUPAC: 3-(2-aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid.
Chemical Property Profile of 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid
Property Insights of 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid
The XLogP value of -0.3 indicates that 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid. Following Lipinski's Rule of Five, 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid has 3 hydrogen bond donor(s) and 3 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-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid?
The CAS number of 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid is 2245-75-2.
What is the molecular formula of 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid?
The molecular formula of 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid is C13H16N2O2.
What is the molecular weight of 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid?
The molecular weight of 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid is 232.12 g/mol.
Where can I buy 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid?
You can request a quote for 3-(2-Aminoethyl)-5,7-dimethyl-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-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Aminoethyl)-5,7-dimethyl-1H-indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.