![4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid structure](/static/products/6944/694498-82-3.webp)
4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid
TL;DR: 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid (CAS 694498-82-3) is a chemical compound with molecular formula C19H21NO4 and molecular weight 327.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-methoxy-3-methylphenyl)butanoylamino]benzoic acid
Also Known As: 4-{[4-(4-methoxy-3-methylphenyl)butanoyl]amino}benzoic acid, 4-[4-(4-methoxy-3-methyl-phenyl)butanoylamino]benzoic Acid, 4-[4-(4-methoxy-3-methylphenyl)butanoylamino]benzoic acid, 4-[4-(4-Methoxy-3-methyl-phenyl)-butyrylamino]-benzoic acid
| Molecular Formula | C19H21NO4 |
|---|---|
| Molecular Weight | 327.15 g/mol |
| LogP | 3.66322 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 327.14706 |
| Heavy Atoms | 24 |
| Complexity | 722.64667 |
Chemical Identifiers
| CAS Number | 694498-82-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)CCCC(=O)NC2=CC=C(C=C2)C(=O)O)OC |
Product Overview
4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid (CAS 694498-82-3), with molecular formula C19H21NO4 and molecular weight 327.15 g/mol. IUPAC: 4-[4-(4-methoxy-3-methylphenyl)butanoylamino]benzoic acid.
Chemical Property Profile of 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid
Property Insights of 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid
The XLogP value of 3.66322 indicates that 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid. Following Lipinski's Rule of Five, 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic 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 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid?
The CAS number of 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid is 694498-82-3.
What is the molecular formula of 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid?
The molecular formula of 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid is C19H21NO4.
What is the molecular weight of 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid?
The molecular weight of 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid is 327.15 g/mol.
Where can I buy 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid?
You can request a quote for 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[4-(4-Methoxy-3-methylphenyl)butanoyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.