![2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid structure](/static/products/4043/404377-20-4.webp)
2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid
TL;DR: 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid (CAS 404377-20-4) is a chemical compound with molecular formula C18H19NO4 and molecular weight 313.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-tert-butylbenzoyl)amino]-5-hydroxybenzoic acid
Also Known As: 2-(4-(tert-butyl)benzamido)-5-hydroxybenzoic acid, 2-[(4-tert-butylbenzoyl)amino]-5-hydroxybenzoic acid, 5-hydroxy-2-[(4-tert-butylbenzoyl)amino]benzoic Acid, 2-{[(4-tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid
| Molecular Formula | C18H19NO4 |
|---|---|
| Molecular Weight | 313.13 g/mol |
| LogP | 3.6402 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.1314 |
| Heavy Atoms | 23 |
| Complexity | 742.6072 |
Chemical Identifiers
| CAS Number | 404377-20-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)O)C(=O)O |
Product Overview
2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid (CAS 404377-20-4), with molecular formula C18H19NO4 and molecular weight 313.13 g/mol. IUPAC: 2-[(4-tert-butylbenzoyl)amino]-5-hydroxybenzoic acid.
Chemical Property Profile of 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid
Property Insights of 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid
The XLogP value of 3.6402 indicates that 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid. Following Lipinski's Rule of Five, 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid has 3 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-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid?
The CAS number of 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid is 404377-20-4.
What is the molecular formula of 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid?
The molecular formula of 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid is C18H19NO4.
What is the molecular weight of 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid?
The molecular weight of 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid is 313.13 g/mol.
Where can I buy 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid?
You can request a quote for 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(4-Tert-butylphenyl)carbonyl]amino}-5-hydroxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.