RefChem:564218
TL;DR: RefChem:564218 (CAS 6405-94-3) is a chemical compound with molecular formula C28H28N8Na2O6S2 and molecular weight 682.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2,4-diamino-3-[[4-[4-[(2,6-diamino-3-methyl-5-sulfonatophenyl)diazenyl]-2-methylphenyl]-3-methylphenyl]diazenyl]-5-methylbenzenesulfonate
Also Known As: 6-bromo-1,3-benzothiazol-2-amine hydrobromide, 6-bromo-1,3-benzothiazol-2-amine,hydrobromide, Benzenesulfonic acid, 3,3'-((3,3'-dimethyl(1,1'-biphenyl)-4,4'-diyl)bis(2,1-diazenediyl))bis(2,4-diamino-5-methyl-, sodium salt (1:2), Benzenesulfonic acid, 3,3'-((3,3'-dimethyl(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(2,4-diamino-5-methyl-, disodium salt, Benzenesulfonic acid, 3,3'-[(3,3'-dimethyl[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[2,4-diamino-5-methyl-, disodium salt
| Molecular Formula | C28H28N8Na2O6S2 |
|---|---|
| Molecular Weight | 682.14 g/mol |
| LogP | -0.44 |
| Topological Polar Surface Area | 285.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 5 |
| Exact Mass | 682.13684 |
| Heavy Atoms | 46 |
| Complexity | 1130.0 |
Chemical Identifiers
| CAS Number | 6405-94-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1N)N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC4=C(C(=CC(=C4N)S(=O)(=O)[O-])C)N)C)C)N)S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | AZNGCEVYPQWCAW-UHFFFAOYSA-L |
Product Overview
RefChem:564218 (CAS 6405-94-3), with molecular formula C28H28N8Na2O6S2 and molecular weight 682.14 g/mol. IUPAC: disodium;2,4-diamino-3-[[4-[4-[(2,6-diamino-3-methyl-5-sulfonatophenyl)diazenyl]-2-methylphenyl]-3-methylphenyl]diazenyl]-5-methylbenzenesulfonate.
Chemical Property Profile of RefChem:564218
Property Insights of RefChem:564218
The XLogP value of -0.44 indicates that RefChem:564218 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 285.0 Ų indicates high polarity, suggesting RefChem:564218 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:564218 has 4 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:564218?
The CAS number of RefChem:564218 is 6405-94-3.
What is the molecular formula of RefChem:564218?
The molecular formula of RefChem:564218 is C28H28N8Na2O6S2.
What is the molecular weight of RefChem:564218?
The molecular weight of RefChem:564218 is 682.14 g/mol.
Where can I buy RefChem:564218?
You can request a quote for RefChem:564218 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:564218?
Yes, KEHONG BIO provides custom synthesis services for RefChem:564218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.