3-Acetamido-5-phenylthiophene-2-carboxylic acid
TL;DR: 3-Acetamido-5-phenylthiophene-2-carboxylic acid (CAS 100727-58-0) is a chemical compound with molecular formula C13H11NO3S and molecular weight 261.04596 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-acetamido-5-phenylthiophene-2-carboxylic acid
Also Known As: 3-acetamido-5-phenylthiophene-2-carboxylic acid, 3-acetamido-5-phenyl-thiophene-2-carboxylic Acid, 3-(acetylamino)-5-phenyl-2-thiophenecarboxylic acid
Technical Specifications
| Molecular Formula | C13H11NO3S |
| Molecular Weight | 261.04596 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 94.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.04596 Da |
| Heavy Atoms | 18 |
| Complexity | 328.0 |
| SMILES | CC(=O)NC1=C(SC(=C1)C2=CC=CC=C2)C(=O)O |
| InChIKey | ZWLNKYKLUIFEHY-UHFFFAOYSA-N |
Chemical Property Profile of 3-Acetamido-5-phenylthiophene-2-carboxylic acid
Property Insights of 3-Acetamido-5-phenylthiophene-2-carboxylic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetamido-5-phenylthiophene-2-carboxylic acid. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Acetamido-5-phenylthiophene-2-carboxylic acid. Following Lipinski's Rule of Five, 3-Acetamido-5-phenylthiophene-2-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
What is the CAS number of 3-Acetamido-5-phenylthiophene-2-carboxylic acid?
The CAS number of 3-Acetamido-5-phenylthiophene-2-carboxylic acid is 100727-58-0.
What is the molecular formula of 3-Acetamido-5-phenylthiophene-2-carboxylic acid?
The molecular formula of 3-Acetamido-5-phenylthiophene-2-carboxylic acid is C13H11NO3S.
What is the molecular weight of 3-Acetamido-5-phenylthiophene-2-carboxylic acid?
The molecular weight of 3-Acetamido-5-phenylthiophene-2-carboxylic acid is 261.04596 g/mol.
Where can I buy 3-Acetamido-5-phenylthiophene-2-carboxylic acid?
You can request a quote for 3-Acetamido-5-phenylthiophene-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Acetamido-5-phenylthiophene-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 3-Acetamido-5-phenylthiophene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.