RefChem:273485
TL;DR: RefChem:273485 (CAS 67828-18-6) is a chemical compound with molecular formula C20H20N2O10S3 and molecular weight 544.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[2,4-dimethyl-5-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]-4-hydroxynaphthalene-1-sulfonic acid
Also Known As: 1-Naphthalenesulfonic acid, 3-((2,4-dimethyl-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)-4-hydroxy-, 1-Naphthalenesulfonic acid, 3-[[2,4-dimethyl-5-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]azo]-4-hydroxy-, 1-Naphthalenesulfonic acid, 3-(2-(2,4-dimethyl-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)diazenyl)-4-hydroxy-, 3-[[2,4-Dimethyl-5-[[2- ethyl]sulfonyl]phenyl]azo]-4-hydroxy-1-naphthalenesulfonicacid, 3-({2,4-Dimethyl-5-[2-(sulfooxy)ethanesulfonyl]phenyl}diazenyl)-4-hydroxynaphthalene-1-sulfonic acid
| Molecular Formula | C20H20N2O10S3 |
|---|---|
| Molecular Weight | 544.03 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 222.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 544.028 |
| Heavy Atoms | 35 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 67828-18-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N=NC2=C(C3=CC=CC=C3C(=C2)S(=O)(=O)O)O)S(=O)(=O)CCOS(=O)(=O)O)C |
| InChIKey | SWPLODLAJSGBPL-UHFFFAOYSA-N |
Product Overview
RefChem:273485 (CAS 67828-18-6), with molecular formula C20H20N2O10S3 and molecular weight 544.03 g/mol. IUPAC: 3-[[2,4-dimethyl-5-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]-4-hydroxynaphthalene-1-sulfonic acid.
Chemical Property Profile of RefChem:273485
Property Insights of RefChem:273485
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:273485. The TPSA of 222.0 Ų indicates high polarity, suggesting RefChem:273485 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:273485 has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:273485?
The CAS number of RefChem:273485 is 67828-18-6.
What is the molecular formula of RefChem:273485?
The molecular formula of RefChem:273485 is C20H20N2O10S3.
What is the molecular weight of RefChem:273485?
The molecular weight of RefChem:273485 is 544.03 g/mol.
Where can I buy RefChem:273485?
You can request a quote for RefChem:273485 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:273485?
Yes, KEHONG BIO provides custom synthesis services for RefChem:273485 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.