7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid
TL;DR: 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid (CAS 69822-26-0) is a chemical compound with molecular formula C18H15NO3 and molecular weight 293.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid
Also Known As: 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid
| Molecular Formula | C18H15NO3 |
|---|---|
| Molecular Weight | 293.11 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.1052 |
| Heavy Atoms | 22 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 69822-26-0 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1)C(=O)C3=CC=CC=C3)NC(=C2C)C(=O)O |
| InChIKey | ZCAYGOVGSXHHGJ-UHFFFAOYSA-N |
Product Overview
7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid (CAS 69822-26-0), with molecular formula C18H15NO3 and molecular weight 293.11 g/mol. IUPAC: 7-benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid.
Chemical Property Profile of 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid
Property Insights of 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid
The XLogP value of 4.0 indicates that 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid. Following Lipinski's Rule of Five, 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid has 2 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 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid?
The CAS number of 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid is 69822-26-0.
What is the molecular formula of 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid?
The molecular formula of 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid is C18H15NO3.
What is the molecular weight of 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid?
The molecular weight of 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid is 293.11 g/mol.
Where can I buy 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid?
You can request a quote for 7-Benzoyl-3,5-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 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 7-Benzoyl-3,5-dimethyl-1H-indole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.