2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid
TL;DR: 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid (CAS 342390-33-4) is a chemical compound with molecular formula C18H21NO3S and molecular weight 331.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic acid
Also Known As: AE-848/34079048, 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid, 2-hexanamido-4-(p-tolyl)thiophene-3-carboxylic acid, 2-(hexanoylamino)-4-(4-methylphenyl)-3-thiophenecarboxylic acid
| Molecular Formula | C18H21NO3S |
|---|---|
| Molecular Weight | 331.12 g/mol |
| LogP | 4.94052 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 331.1242 |
| Heavy Atoms | 23 |
| Complexity | 688.7923 |
Chemical Identifiers
| CAS Number | 342390-33-4 |
|---|---|
| SMILES | CCCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)O |
Product Overview
2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid (CAS 342390-33-4), with molecular formula C18H21NO3S and molecular weight 331.12 g/mol. IUPAC: 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic acid.
Chemical Property Profile of 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid
Property Insights of 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid
The XLogP value of 4.94052 indicates that 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid. Following Lipinski's Rule of Five, 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-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 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid?
The CAS number of 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid is 342390-33-4.
What is the molecular formula of 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid?
The molecular formula of 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid is C18H21NO3S.
What is the molecular weight of 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid?
The molecular weight of 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid is 331.12 g/mol.
Where can I buy 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid?
You can request a quote for 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-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-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(hexanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.