RefChem:589319
TL;DR: RefChem:589319 (CAS 71033-19-7) is a chemical compound with molecular formula C32H26N10Na2O8S3 and molecular weight 820.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;3-[5-amino-4-[[4-[4-[[5-amino-3-methyl-1-(3-sulfonatophenyl)pyrazol-4-yl]diazenyl]phenyl]sulfonylphenyl]diazenyl]-3-methylpyrazol-1-yl]benzenesulfonate
Also Known As: disodium3,3'-[sulphonylbis[p-phenyleneazo ]]bis, Benzenesulfonic acid, 3,3'-(sulfonylbis(4,1-phenyleneazo(5-imino-3-methyl-1H-pyrazole-4,1-diyl)))bis-, disodium salt, Benzenesulfonic acid, 3,3'-[sulfonylbis[4,1-phenyleneazo(5-imino-3-methyl-1H-pyrazole-4,1-diyl)]]bis-, disodium salt, 3,3'-(Sulfonylbis(4,1-phenyleneazo(4,5-dihydro-5-imino-3-methyl-1H-pyrazole-4,1-diyl)))bisbenzenesulfonic acid, disodium salt, Benzenesulfonic acid, 3,3'-(sulfonylbis(4,1-phenylene-2,1-diazenediyl(5-imino-3-methyl-1H-pyrazole-4,1-diyl)))bis-, sodium salt (1:2)
| Molecular Formula | C32H26N10Na2O8S3 |
|---|---|
| Molecular Weight | 820.09 g/mol |
| LogP | -0.68096 |
| Topological Polar Surface Area | 311.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 8 |
| Exact Mass | 820.08923 |
| Heavy Atoms | 55 |
| Complexity | 1500.0 |
Chemical Identifiers
| CAS Number | 71033-19-7 |
|---|---|
| SMILES | CC1=NN(C(=C1N=NC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N=NC4=C(N(N=C4C)C5=CC(=CC=C5)S(=O)(=O)[O-])N)N)C6=CC(=CC=C6)S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | CIVBIBJRESSNNG-UHFFFAOYSA-L |
Product Overview
RefChem:589319 (CAS 71033-19-7), with molecular formula C32H26N10Na2O8S3 and molecular weight 820.09 g/mol. IUPAC: disodium;3-[5-amino-4-[[4-[4-[[5-amino-3-methyl-1-(3-sulfonatophenyl)pyrazol-4-yl]diazenyl]phenyl]sulfonylphenyl]diazenyl]-3-methylpyrazol-1-yl]benzenesulfonate.
Chemical Property Profile of RefChem:589319
Property Insights of RefChem:589319
The XLogP value of -0.68096 indicates that RefChem:589319 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 311.0 Ų indicates high polarity, suggesting RefChem:589319 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:589319 has 2 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:589319?
The CAS number of RefChem:589319 is 71033-19-7.
What is the molecular formula of RefChem:589319?
The molecular formula of RefChem:589319 is C32H26N10Na2O8S3.
What is the molecular weight of RefChem:589319?
The molecular weight of RefChem:589319 is 820.09 g/mol.
Where can I buy RefChem:589319?
You can request a quote for RefChem:589319 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:589319?
Yes, KEHONG BIO provides custom synthesis services for RefChem:589319 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.