![5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid structure](/static/products/5002/500261-79-0.webp)
5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid
TL;DR: 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid (CAS 500261-79-0) is a chemical compound with molecular formula C18H18INO3 and molecular weight 423.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-tert-butylbenzoyl)amino]-2-iodobenzoic acid
Also Known As: 5-[(4-tert-butylbenzoyl)amino]-2-iodobenzoic acid, 5-(4-(tert-butyl)benzamido)-2-iodobenzoic acid, AN-979/40826975, 2-iodo-5-[(4-tert-butylbenzoyl)amino]benzoic Acid, 5-{[(4-tert-butylphenyl)carbonyl]amino}-2-iodobenzoic acid
| Molecular Formula | C18H18INO3 |
|---|---|
| Molecular Weight | 423.03 g/mol |
| LogP | 4.5392 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.03314 |
| Heavy Atoms | 23 |
| Complexity | 745.8523 |
Chemical Identifiers
| CAS Number | 500261-79-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)I)C(=O)O |
Product Overview
5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid (CAS 500261-79-0), with molecular formula C18H18INO3 and molecular weight 423.03 g/mol. IUPAC: 5-[(4-tert-butylbenzoyl)amino]-2-iodobenzoic acid.
Chemical Property Profile of 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid
Property Insights of 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid
The XLogP value of 4.5392 indicates that 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic 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 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid. Following Lipinski's Rule of Five, 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic 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 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid?
The CAS number of 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid is 500261-79-0.
What is the molecular formula of 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid?
The molecular formula of 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid is C18H18INO3.
What is the molecular weight of 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid?
The molecular weight of 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid is 423.03 g/mol.
Where can I buy 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid?
You can request a quote for 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-Tert-butylbenzoyl)amino]-2-iodobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.