7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid
TL;DR: 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid (CAS 119-77-7) is a chemical compound with molecular formula C17H14N2O5S and molecular weight 358.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(4-aminobenzoyl)amino]-4-hydroxynaphthalene-2-sulfonic acid
Also Known As: p-Aminobenzoyl I Acid, PAB J Acid, p-Aminobenzoyl J Acid, 2-Naphthalenesulfonic acid, 7-[(4-aminobenzoyl)amino]-4-hydroxy-, 7-[(4-aminobenzoyl)amino]-4-hydroxynaphthalene-2-sulfonic acid
| Molecular Formula | C17H14N2O5S |
|---|---|
| Molecular Weight | 358.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.06235 |
| Heavy Atoms | 25 |
| Complexity | 582.0 |
Chemical Identifiers
| CAS Number | 119-77-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)O)N |
| InChIKey | BRIUJVAXLMLKPY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid (CAS 119-77-7), with molecular formula C17H14N2O5S and molecular weight 358.06 g/mol. IUPAC: 7-[(4-aminobenzoyl)amino]-4-hydroxynaphthalene-2-sulfonic acid.
Chemical Property Profile of 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid
Property Insights of 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid. Following Lipinski's Rule of Five, 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid has 4 hydrogen bond donor(s) and 6 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 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid?
The CAS number of 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid is 119-77-7.
What is the molecular formula of 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid?
The molecular formula of 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid is C17H14N2O5S.
What is the molecular weight of 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid?
The molecular weight of 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid is 358.06 g/mol.
Where can I buy 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid?
You can request a quote for 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 7-(4-Aminobenzamido)-4-hydroxynaphthalene-2-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.