2-benzoyl-1H-indole-3-carboxylic acid
TL;DR: 2-benzoyl-1H-indole-3-carboxylic acid (CAS 314763-97-8) is a chemical compound with molecular formula C16H11NO3 and molecular weight 265.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzoyl-1H-indole-3-carboxylic acid
Also Known As: 2-benzoyl-1H-indole-3-carboxylic acid, 3-iodo-4-methoxybenzohydrazide, 1H-Indole-3-carboxylic acid, 2-benzoyl-, 2-benzoylindole-3-carboxylic acid, 2-benzoyl-indole-3-carboxylic acid
| Molecular Formula | C16H11NO3 |
|---|---|
| Molecular Weight | 265.07 g/mol |
| LogP | 3.0971 |
| Topological Polar Surface Area | 70.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.07388 |
| Heavy Atoms | 20 |
| Complexity | 802.95984 |
Chemical Identifiers
| CAS Number | 314763-97-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3N2)C(=O)O |
Product Overview
2-benzoyl-1H-indole-3-carboxylic acid (CAS 314763-97-8), with molecular formula C16H11NO3 and molecular weight 265.07 g/mol. IUPAC: 2-benzoyl-1H-indole-3-carboxylic acid.
Chemical Property Profile of 2-benzoyl-1H-indole-3-carboxylic acid
Property Insights of 2-benzoyl-1H-indole-3-carboxylic acid
The XLogP value of 3.0971 indicates that 2-benzoyl-1H-indole-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-benzoyl-1H-indole-3-carboxylic acid. Following Lipinski's Rule of Five, 2-benzoyl-1H-indole-3-carboxylic acid has 2 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 2-benzoyl-1H-indole-3-carboxylic acid?
The CAS number of 2-benzoyl-1H-indole-3-carboxylic acid is 314763-97-8.
What is the molecular formula of 2-benzoyl-1H-indole-3-carboxylic acid?
The molecular formula of 2-benzoyl-1H-indole-3-carboxylic acid is C16H11NO3.
What is the molecular weight of 2-benzoyl-1H-indole-3-carboxylic acid?
The molecular weight of 2-benzoyl-1H-indole-3-carboxylic acid is 265.07 g/mol.
Where can I buy 2-benzoyl-1H-indole-3-carboxylic acid?
You can request a quote for 2-benzoyl-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 2-benzoyl-1H-indole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-benzoyl-1H-indole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.