1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)-
TL;DR: 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)- (CAS 68003-37-2) is a chemical compound with molecular formula C16H13NO4S and molecular weight 315.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-anilino-5-hydroxynaphthalene-1-sulfonic acid
Also Known As: 4-anilino-5-hydroxynaphthalene-1-sulfonic acid, 1-Naphthol-5-sulfonic acid, 8-anilino-, 1-Anilino-8-hydroxynaphthalene-4-sulfonic acid, 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)-, 5-Hydroxy-4-(phenylamino)naphthalenesulphonic acid
| Molecular Formula | C16H13NO4S |
|---|---|
| Molecular Weight | 315.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 95.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.05652 |
| Heavy Atoms | 22 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 68003-37-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C3C(=C(C=C2)S(=O)(=O)O)C=CC=C3O |
| InChIKey | JJOWOYSYGITZPN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)- (CAS 68003-37-2), with molecular formula C16H13NO4S and molecular weight 315.06 g/mol. IUPAC: 4-anilino-5-hydroxynaphthalene-1-sulfonic acid.
Chemical Property Profile of 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)-
Property Insights of 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)-
The XLogP value of 3.7 indicates that 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)-. Following Lipinski's Rule of Five, 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)- 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 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)-?
The CAS number of 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)- is 68003-37-2.
What is the molecular formula of 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)-?
The molecular formula of 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)- is C16H13NO4S.
What is the molecular weight of 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)-?
The molecular weight of 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)- is 315.06 g/mol.
Where can I buy 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)-?
You can request a quote for 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Naphthalenesulfonic acid, 5-hydroxy-4-(phenylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.