RefChem:579815
TL;DR: RefChem:579815 (CAS 38362-23-1) is a chemical compound with molecular formula C18H15CuN3O14S4 and molecular weight 687.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
copper;4-amino-5-oxido-6-[[2-oxido-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-1,7-disulfonate;hydron
Also Known As: Cuprate(3-), (4-amino-5-(hydroxy-kappaO)-6-(2-(2-(hydroxy-kappaO)-4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)diazenyl-kappaN1)-1,7-naphthalenedisulfonato(5-))-, hydrogen (1:3), Cuprate(3-), (4-amino-5-hydroxy-6-((2-hydroxy-4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)-1,7-naphthalenedisulfonato(5-))-, trihydrogen, copper(2+) hydrogen 4-amino-5-oxido-6-[(e)-(2-oxido-4-{[2-(sulfonatooxy)ethyl]sulfonyl}phenyl)diazenyl]naphthalene-1,7-disulfonate(1:3:1), copper; 4-amino-5-oxido-6-[[2-oxido-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-1,7-disulfonate; hydron, Cuprate(3-), [4-amino-5-(hydroxy-.kappa.O)-6-[2-[2-(hydroxy-.kappa.O)-4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]diazenyl-.kappa.N1]-1,7-naphthalenedisulfonato(5-)]-, hydrogen (1:3)
| Molecular Formula | C18H15CuN3O14S4 |
|---|---|
| Molecular Weight | 687.87 g/mol |
| LogP | -0.6217 |
| Topological Polar Surface Area | 345.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 6 |
| Exact Mass | 687.8733 |
| Heavy Atoms | 40 |
| Complexity | 1290.0 |
Chemical Identifiers
| CAS Number | 38362-23-1 |
|---|---|
| SMILES | [H+].[H+].[H+].C1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)[O-])[O-])N=NC2=C(C3=C(C=CC(=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N)[O-].[Cu+2] |
| InChIKey | MVHOHWZYPOEPSB-UHFFFAOYSA-L |
Product Overview
RefChem:579815 (CAS 38362-23-1), with molecular formula C18H15CuN3O14S4 and molecular weight 687.87 g/mol. IUPAC: copper;4-amino-5-oxido-6-[[2-oxido-4-(2-sulfonatooxyethylsulfonyl)phenyl]diazenyl]naphthalene-1,7-disulfonate;hydron.
Chemical Property Profile of RefChem:579815
Property Insights of RefChem:579815
The XLogP value of -0.6217 indicates that RefChem:579815 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 345.0 Ų indicates high polarity, suggesting RefChem:579815 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:579815 has 4 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:579815?
The CAS number of RefChem:579815 is 38362-23-1.
What is the molecular formula of RefChem:579815?
The molecular formula of RefChem:579815 is C18H15CuN3O14S4.
What is the molecular weight of RefChem:579815?
The molecular weight of RefChem:579815 is 687.87 g/mol.
Where can I buy RefChem:579815?
You can request a quote for RefChem:579815 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:579815?
Yes, KEHONG BIO provides custom synthesis services for RefChem:579815 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.