RefChem:579821
TL;DR: RefChem:579821 (CAS 66225-59-0) is a chemical compound with molecular formula C33H18Cu2N7Na3O16S4 and molecular weight 1090.7977 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dicopper;trisodium;4-oxido-7-[[5-oxido-6-[(2-oxido-5-sulfamoylphenyl)diazenyl]-7-sulfonatonaphthalen-2-yl]carbamoylamino]-3-[(2-oxido-4-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate
Also Known As: Cuprate(3-), (mu-(3-((5-(aminosulfonyl)-2-hydroxyphenyl)azo)-4-hydroxy-7-((((5-hydroxy-6-((2-hydroxy-4-sulfophenyl)azo)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-2-naphthalenesulfonato(7-)))di-, trisodium, Cuprate(3-), (mu-(3-(2-(5-(aminosulfonyl)-2-(hydroxy-kappaO)phenyl)diazenyl-kappaN1)-4-(hydroxy-kappaO)-7-((((5-hydroxy-6-(2-(2-(hydroxy-kappaO)-4-sulfophenyl)diazenyl-kappaN1)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-2-naphthalenesulfonato(7-)))di-, sodium (1:3), copper(2+) sodium 4-oxido-7-[({5-oxido-6-[(e)-(2-oxido-5-sulfamoylphenyl)diazenyl]-7-sulfonatonaphthalen-2-yl}carbamoyl)amino]-3-[(e)-(2-oxido-4-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate(2:3:1), Cuprate(3-), (mu-(3-((5-(aminosulfonyl)-2-(hydroxy-kappaO)phenyl)azo-kappaN1)-4-(hydroxy-kappaO)-7-((((5-hydroxy-6-((2-(hydroxy-kappaO)-4-sulfophenyl)azo-kappaN1)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-2-naphthalenesulfonato(7-)))di-, trisodium, Cuprate(3-), [.mu.-[3-[2-[5-(aminosulfonyl)-2-(hydroxy-.kappa.O)phenyl]diazenyl-.kappa.N1]-4-(hydroxy-.kappa.O)-7-[[[[5-hydroxy-6-[2-[2-(hydroxy-.kappa.O)-4-sulfophenyl]diazenyl-.kappa.N1]-7-sulfo-2-naphthalenyl]amino]carbonyl]amino]-2-naphthalenesulfonato(7-)]]di-, sodium (1:3)
Technical Specifications
| Molecular Formula | C33H18Cu2N7Na3O16S4 |
| Molecular Weight | 1090.7977 g/mol |
| XLogP | -6.87 |
| Topological Polar Surface Area (TPSA) | 448.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 7 |
| Exact Mass | 1090.7977 Da |
| Heavy Atoms | 65 |
| Complexity | 2020.0 |
| SMILES | C1=CC2=C(C(=C(C=C2C=C1NC(=O)NC3=CC4=CC(=C(C(=C4C=C3)[O-])N=NC5=C(C=CC(=C5)S(=O)(=O)N)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC6=C(C=C(C=C6)S(=O)(=O)[O-])[O-])[O-].[Na+].[Na+].[Na+].[Cu+2].[Cu+2] |
| InChIKey | WXMJJBUBGSNDPR-UHFFFAOYSA-G |
Chemical Property Profile of RefChem:579821
Property Insights of RefChem:579821
The XLogP value of -6.87 indicates that RefChem:579821 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 448.0 Ų indicates high polarity, suggesting RefChem:579821 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:579821 has 3 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:579821?
The CAS number of RefChem:579821 is 66225-59-0.
What is the molecular formula of RefChem:579821?
The molecular formula of RefChem:579821 is C33H18Cu2N7Na3O16S4.
What is the molecular weight of RefChem:579821?
The molecular weight of RefChem:579821 is 1090.7977 g/mol.
Where can I buy RefChem:579821?
You can request a quote for RefChem:579821 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:579821?
Yes, CoreyChem provides custom synthesis services for RefChem:579821 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.