6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid
TL;DR: 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid (CAS 224181-99-1) is a chemical compound with molecular formula C12H11NO4 and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-acetamido-1-oxo-2,3-dihydroindene-4-carboxylic acid
Also Known As: 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid, 1330AB, 6-acetamido-1-oxo-2,3-dihydroindene-4-carboxylic acid, 6-acetylamino-1-oxo-indan-4-carboxylic acid, 6-(acetylamino)-1-oxoindane-4-carboxylic acid
| Molecular Formula | C12H11NO4 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.0688 |
| Heavy Atoms | 17 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 224181-99-1 |
|---|---|
| SMILES | CC(=O)NC1=CC2=C(CCC2=O)C(=C1)C(=O)O |
| InChIKey | UQYUQBXSSTZMPY-UHFFFAOYSA-N |
Product Overview
6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid (CAS 224181-99-1), with molecular formula C12H11NO4 and molecular weight 233.07 g/mol. IUPAC: 6-acetamido-1-oxo-2,3-dihydroindene-4-carboxylic acid.
Chemical Property Profile of 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid
Property Insights of 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid. Following Lipinski's Rule of Five, 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid has 2 hydrogen bond donor(s) and 4 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 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid?
The CAS number of 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid is 224181-99-1.
What is the molecular formula of 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid?
The molecular formula of 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid is C12H11NO4.
What is the molecular weight of 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid?
The molecular weight of 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid is 233.07 g/mol.
Where can I buy 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid?
You can request a quote for 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Acetamido-1-oxo-2,3-dihydro-1H-indene-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.