RefChem:83460
TL;DR: RefChem:83460 (CAS 82996-64-3) is a chemical compound with molecular formula C39H32N6Na4O17S4 and molecular weight 1076.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrasodium;4-[[4-[[4-[(3,6-disulfonatonaphthalen-1-yl)diazenyl]-2,6-dimethoxy-3-methylphenyl]carbamoylamino]-3,5-dimethoxy-2-methylphenyl]diazenyl]naphthalene-2,7-disulfonate
Also Known As: 2,7-Naphthalenedisulfonic acid, 4,4'-(carbonylbis(imino(5-dimethoxy-2-methyl-4,1-phenylene)azo))bis-, tetrasodium salt, 2,7-Naphthalenedisulfonic acid, 4,4'-(carbonylbis(imino(5-methoxy-2-methyl-4,1-phenylene)-2,1-diazenediyl))bis-, sodium salt (1:4), 2,7-Naphthalenedisulfonic acid, 4,4'-[carbonylbis[imino(5-dimethoxy-2-methyl-4,1-phenylene)azo]]bis-, tetrasodium salt, 2,7-Naphthalenedisulfonic acid, 4,4'-[carbonylbis[imino(5-methoxy-2-methyl-4,1-phenylene)-2,1-diazenediyl]]bis-, sodium salt (1:4), tetrasodium4,4'-[carbonylbis[imino azo]]bisnaphthalene-2,7-disulphonate
| Molecular Formula | C39H32N6Na4O17S4 |
|---|---|
| Molecular Weight | 1076.03 g/mol |
| LogP | -5.24856 |
| Topological Polar Surface Area | 390.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 10 |
| Exact Mass | 1076.0298 |
| Heavy Atoms | 70 |
| Complexity | 1990.0 |
Chemical Identifiers
| CAS Number | 82996-64-3 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1N=NC2=C3C=CC(=CC3=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4OC)C)N=NC5=C6C=CC(=CC6=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)OC.[Na+].[Na+].[Na+].[Na+] |
| InChIKey | RANIZIWYBGWVJM-UHFFFAOYSA-J |
Product Overview
RefChem:83460 (CAS 82996-64-3), with molecular formula C39H32N6Na4O17S4 and molecular weight 1076.03 g/mol. IUPAC: tetrasodium;4-[[4-[[4-[(3,6-disulfonatonaphthalen-1-yl)diazenyl]-2,6-dimethoxy-3-methylphenyl]carbamoylamino]-3,5-dimethoxy-2-methylphenyl]diazenyl]naphthalene-2,7-disulfonate.
Chemical Property Profile of RefChem:83460
Property Insights of RefChem:83460
The XLogP value of -5.24856 indicates that RefChem:83460 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 390.0 Ų indicates high polarity, suggesting RefChem:83460 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:83460 has 2 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:83460?
The CAS number of RefChem:83460 is 82996-64-3.
What is the molecular formula of RefChem:83460?
The molecular formula of RefChem:83460 is C39H32N6Na4O17S4.
What is the molecular weight of RefChem:83460?
The molecular weight of RefChem:83460 is 1076.03 g/mol.
Where can I buy RefChem:83460?
You can request a quote for RefChem:83460 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:83460?
Yes, KEHONG BIO provides custom synthesis services for RefChem:83460 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.