RefChem:434860
TL;DR: RefChem:434860 (CAS 70247-69-7) is a chemical compound with molecular formula C48H34N6Na2O14S2 and molecular weight 1028.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;3-hydroxy-4-[[2-hydroxy-4-[[4-[4-[[3-hydroxy-4-[(2-hydroxy-4-sulfonatonaphthalen-1-yl)diazenyl]benzoyl]amino]-3-methoxyphenyl]-2-methoxyphenyl]carbamoyl]phenyl]diazenyl]naphthalene-1-sulfonate
Also Known As: 1-Naphthalenesulfonic acid, 4,4'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(iminocarbonyl(2-hydroxy-4,1-phenylene)-2,1-diazenediyl))bis(3-hydroxy-, sodium salt (1:2), 1-Naphthalenesulfonic acid, 4,4'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(iminocarbonyl(2-hydroxy-4,1-phenylene)azo))bis(3-hydroxy-, disodium salt, 1-Naphthalenesulfonic acid, 4,4'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis[iminocarbonyl(2-hydroxy-4,1-phenylene)-2,1-diazenediyl]]bis[3-hydroxy-, sodium salt (1:2), 1-Naphthalenesulfonic acid, 4,4'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis[iminocarbonyl(2-hydroxy-4,1-phenylene)azo]]bis[3-hydroxy-, disodium salt, Disodium 4,4'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(iminocarbonyl(2-hydroxy-4,1-phenylene)azo))bis(3-hydroxynaphthalene-1-sulphonate)
| Molecular Formula | C48H34N6Na2O14S2 |
|---|---|
| Molecular Weight | 1028.14 g/mol |
| LogP | 3.65 |
| Topological Polar Surface Area | 338.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 11 |
| Exact Mass | 1028.137 |
| Heavy Atoms | 72 |
| Complexity | 1910.0 |
Chemical Identifiers
| CAS Number | 70247-69-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=CC(=C(C=C3)N=NC4=C(C=C(C5=CC=CC=C54)S(=O)(=O)[O-])O)O)OC)NC(=O)C6=CC(=C(C=C6)N=NC7=C(C=C(C8=CC=CC=C87)S(=O)(=O)[O-])O)O.[Na+].[Na+] |
| InChIKey | HSUWQXUFFFBTQL-UHFFFAOYSA-L |
Product Overview
RefChem:434860 (CAS 70247-69-7), with molecular formula C48H34N6Na2O14S2 and molecular weight 1028.14 g/mol. IUPAC: disodium;3-hydroxy-4-[[2-hydroxy-4-[[4-[4-[[3-hydroxy-4-[(2-hydroxy-4-sulfonatonaphthalen-1-yl)diazenyl]benzoyl]amino]-3-methoxyphenyl]-2-methoxyphenyl]carbamoyl]phenyl]diazenyl]naphthalene-1-sulfonate.
Chemical Property Profile of RefChem:434860
Property Insights of RefChem:434860
The XLogP value of 3.65 indicates that RefChem:434860 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 338.0 Ų indicates high polarity, suggesting RefChem:434860 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:434860 has 6 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:434860?
The CAS number of RefChem:434860 is 70247-69-7.
What is the molecular formula of RefChem:434860?
The molecular formula of RefChem:434860 is C48H34N6Na2O14S2.
What is the molecular weight of RefChem:434860?
The molecular weight of RefChem:434860 is 1028.14 g/mol.
Where can I buy RefChem:434860?
You can request a quote for RefChem:434860 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:434860?
Yes, KEHONG BIO provides custom synthesis services for RefChem:434860 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.