![4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid structure](/static/products/6101/61013-96-5.webp)
4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid
TL;DR: 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid (CAS 61013-96-5) is a chemical compound with molecular formula C17H13NO5S and molecular weight 343.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic acid
Also Known As: 3-HYDROXY-N-(4-SULFOBPHENYL)-2-NAPHTHAMIDE, 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid, J1.057.246K, 4-[(3-Hydroxy-2-naphthoyl)amino]benzenesulfonic acid, N-(4-Sulfophenyl)-2-hydroxy-3-naphthalenecarboxamide
| Molecular Formula | C17H13NO5S |
|---|---|
| Molecular Weight | 343.05 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.05145 |
| Heavy Atoms | 24 |
| Complexity | 550.0 |
Chemical Identifiers
| CAS Number | 61013-96-5 |
|---|---|
| SMILES | C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC=C(C=C3)S(=O)(=O)O)O |
| InChIKey | YRMKHCQEIHHYEE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid (CAS 61013-96-5), with molecular formula C17H13NO5S and molecular weight 343.05 g/mol. IUPAC: 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic acid.
Chemical Property Profile of 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid
Property Insights of 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid
The XLogP value of 3.0 indicates that 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid. Following Lipinski's Rule of Five, 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid has 3 hydrogen bond donor(s) and 5 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-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid?
The CAS number of 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid is 61013-96-5.
What is the molecular formula of 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid?
The molecular formula of 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid is C17H13NO5S.
What is the molecular weight of 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid?
The molecular weight of 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid is 343.05 g/mol.
Where can I buy 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid?
You can request a quote for 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3-hydroxynaphthalene-2-carbonyl)amino]benzenesulfonic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.