RefChem:563731
TL;DR: RefChem:563731 (CAS 67892-97-1) is a chemical compound with molecular formula C17H16N4O6S2 and molecular weight 436.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-4-[[2-hydroxy-8-(methanesulfonamido)naphthalen-1-yl]diazenyl]benzenesulfonamide
Also Known As: Benzenesulfonamide, 3-hydroxy-4-((2-hydroxy-8-((methylsulfonyl)amino)-1-naphthalenyl)azo)-, Benzenesulfonamide, 3-hydroxy-4-[[2-hydroxy-8-[(methylsulfonyl)amino]-1-naphthalenyl]azo]-, 2-Hydroxy-8-(methylsulfonamido)-1-((2-hydroxy-4-sulfamylphenyl)azo)naphthalene, 2-Hydroxy-8-N-(methylsulfonamido)-1-((2-hydroxy-4-sulfamylphenyl)azo)naphthalene, 3-HYDROXY-4-[[2-HYDROXY-8-[(METHYLSULPHONYL)AMINO]-1-NAPHTHYL]AZO]BENZENESULPHONAMIDE
| Molecular Formula | C17H16N4O6S2 |
|---|---|
| Molecular Weight | 436.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 188.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 436.05112 |
| Heavy Atoms | 29 |
| Complexity | 807.0 |
Chemical Identifiers
| CAS Number | 67892-97-1 |
|---|---|
| SMILES | CS(=O)(=O)NC1=CC=CC2=C1C(=C(C=C2)O)N=NC3=C(C=C(C=C3)S(=O)(=O)N)O |
| InChIKey | XRGSXTJQRFQENP-UHFFFAOYSA-N |
Product Overview
RefChem:563731 (CAS 67892-97-1), with molecular formula C17H16N4O6S2 and molecular weight 436.05 g/mol. IUPAC: 3-hydroxy-4-[[2-hydroxy-8-(methanesulfonamido)naphthalen-1-yl]diazenyl]benzenesulfonamide.
Chemical Property Profile of RefChem:563731
Property Insights of RefChem:563731
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:563731. The TPSA of 188.0 Ų indicates high polarity, suggesting RefChem:563731 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:563731 has 4 hydrogen bond donor(s) and 10 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 RefChem:563731?
The CAS number of RefChem:563731 is 67892-97-1.
What is the molecular formula of RefChem:563731?
The molecular formula of RefChem:563731 is C17H16N4O6S2.
What is the molecular weight of RefChem:563731?
The molecular weight of RefChem:563731 is 436.05 g/mol.
Where can I buy RefChem:563731?
You can request a quote for RefChem:563731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:563731?
Yes, KEHONG BIO provides custom synthesis services for RefChem:563731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.