RefChem:476723
TL;DR: RefChem:476723 (CAS 68133-27-7) is a chemical compound with molecular formula C18H17N3O8S2 and molecular weight 467.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-3-[(4-methoxy-2-sulfophenyl)diazenyl]-6-(methylamino)naphthalene-2-sulfonic acid
Also Known As: 2-Naphthalenesulfonic acid, 4-hydroxy-3-((4-methoxy-2-sulfophenyl)azo)-6-(methylamino)-, 4-Hydroxy-3-((4-methoxy-2-sulfophenyl)azo)-6-(methylamino)-2-naphthalenesulfonic acid, 4-hydroxy-3-[ azo]-6- naphthalene-2-sulphonicacid, 4-hydroxy-3-[azo]-6- naphthalene-2-sulphonicacid, 2-Naphthalenesulfonic acid, 4-hydroxy-3-(2-(4-methoxy-2-sulfophenyl)diazenyl)-6-(methylamino)-
| Molecular Formula | C18H17N3O8S2 |
|---|---|
| Molecular Weight | 467.05 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 467.04572 |
| Heavy Atoms | 31 |
| Complexity | 854.0 |
Chemical Identifiers
| CAS Number | 68133-27-7 |
|---|---|
| SMILES | CNC1=CC2=C(C(=C(C=C2C=C1)S(=O)(=O)O)N=NC3=C(C=C(C=C3)OC)S(=O)(=O)O)O |
| InChIKey | XHHWJFFOFMYBHG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:476723 (CAS 68133-27-7), with molecular formula C18H17N3O8S2 and molecular weight 467.05 g/mol. IUPAC: 4-hydroxy-3-[(4-methoxy-2-sulfophenyl)diazenyl]-6-(methylamino)naphthalene-2-sulfonic acid.
Chemical Property Profile of RefChem:476723
Property Insights of RefChem:476723
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:476723. The TPSA of 192.0 Ų indicates high polarity, suggesting RefChem:476723 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:476723 has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:476723?
The CAS number of RefChem:476723 is 68133-27-7.
What is the molecular formula of RefChem:476723?
The molecular formula of RefChem:476723 is C18H17N3O8S2.
What is the molecular weight of RefChem:476723?
The molecular weight of RefChem:476723 is 467.05 g/mol.
Where can I buy RefChem:476723?
You can request a quote for RefChem:476723 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:476723?
Yes, KEHONG BIO provides custom synthesis services for RefChem:476723 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.