RefChem:118486
TL;DR: RefChem:118486 (CAS 1185263-79-9) is a chemical compound with molecular formula C30H20N6Na2O8S and molecular weight 670.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;5-[[4-[[4-[(7-amino-1-hydroxy-3-sulfonatonaphthalen-2-yl)diazenyl]phenyl]carbamoyl]phenyl]diazenyl]-2-hydroxybenzoate
Also Known As: Benzoic acid, 5-((4-(((4-((7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo)phenyl)amino)carbonyl)phenyl)azo)-2-hydroxy-, disodium salt, Benzoic acid, 5-(2-(4-(((4-(2-(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)phenyl)amino)carbonyl)phenyl)diazenyl)-2-hydroxy-, sodium salt (1:2), Disodium 5-((4-(((4-((7-amino-1-hydroxy-3-sulphonato-2-naphthyl)azo)phenyl)amino)carbonyl)phenyl)azo)salicylate, Benzoic acid, 5-[2-[4-[[[4-[2-(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]phenyl]amino]carbonyl]phenyl]diazenyl]-2-hydroxy-, sodium salt (1:2), Benzoic acid, 5-[(1E)-2-[4-[[[4-[(1E)-2-(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]phenyl]amino]carbonyl]phenyl]diazenyl]-2-hydroxy-, sodium salt (1:2)
| Molecular Formula | C30H20N6Na2O8S |
|---|---|
| Molecular Weight | 670.09 g/mol |
| LogP | -0.8081 |
| Topological Polar Surface Area | 251.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 670.0859 |
| Heavy Atoms | 47 |
| Complexity | 1180.0 |
Chemical Identifiers
| CAS Number | 1185263-79-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)N=NC3=C(C=C4C=CC(=CC4=C3O)N)S(=O)(=O)[O-])N=NC5=CC(=C(C=C5)O)C(=O)[O-].[Na+].[Na+] |
| InChIKey | WKJLXUBMIJDHIZ-UHFFFAOYSA-L |
Product Overview
RefChem:118486 (CAS 1185263-79-9), with molecular formula C30H20N6Na2O8S and molecular weight 670.09 g/mol. IUPAC: disodium;5-[[4-[[4-[(7-amino-1-hydroxy-3-sulfonatonaphthalen-2-yl)diazenyl]phenyl]carbamoyl]phenyl]diazenyl]-2-hydroxybenzoate.
Chemical Property Profile of RefChem:118486
Property Insights of RefChem:118486
The XLogP value of -0.8081 indicates that RefChem:118486 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 251.0 Ų indicates high polarity, suggesting RefChem:118486 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:118486 has 4 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:118486?
The CAS number of RefChem:118486 is 1185263-79-9.
What is the molecular formula of RefChem:118486?
The molecular formula of RefChem:118486 is C30H20N6Na2O8S.
What is the molecular weight of RefChem:118486?
The molecular weight of RefChem:118486 is 670.09 g/mol.
Where can I buy RefChem:118486?
You can request a quote for RefChem:118486 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:118486?
Yes, KEHONG BIO provides custom synthesis services for RefChem:118486 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.