Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2)
TL;DR: Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2) (CAS 75268-65-4) is a chemical compound with molecular formula C24H19ClFN9Na2O9S2 and molecular weight 741.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2-[(5-carbamoyl-1-ethyl-6-hydroxy-4-methyl-2-oxo-3-pyridinyl)diazenyl]-4-[[4-(2-chloro-5-sulfonatoanilino)-6-fluoro-1,3,5-triazin-2-yl]amino]benzenesulfonate
Also Known As: Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2), Benzenesulfonic acid, 2-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, disodium salt, Benzenesulfonic acid, 2-[[5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl]azo]-4-[[4-[(2-chloro-5-sulfophenyl)amino]-6-fluoro-1,3,5-triazin-2-yl]amino]-, disodium salt, 2-((2-Chloro-5-sulfophenyl)amino)-4-fluoro-6-((3-((1-ethyl-3-carbamoyl-4-methyl-6-hydroxy-1,2-dihydro-2-oxo-5-pyrimidinyl)azo)-4-sulfophenyl)amino)-1,3,5-triazine,disodium salt, Disodium 2-((5-carbamoyl-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridyl)azo)-4-((4-((2-chloro-5-sulphonatophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)benzenesulphonate
| Molecular Formula | C24H19ClFN9Na2O9S2 |
|---|---|
| Molecular Weight | 741.02 g/mol |
| LogP | -3.32258 |
| Topological Polar Surface Area | 302.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 8 |
| Exact Mass | 741.0215 |
| Heavy Atoms | 48 |
| Complexity | 1480.0 |
Chemical Identifiers
| CAS Number | 75268-65-4 |
|---|---|
| SMILES | CCN1C(=C(C(=C(C1=O)N=NC2=C(C=CC(=C2)NC3=NC(=NC(=N3)F)NC4=C(C=CC(=C4)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])C)C(=O)N)O.[Na+].[Na+] |
| InChIKey | QGICSQUXJMZAPN-UHFFFAOYSA-L |
Product Overview
Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2) (CAS 75268-65-4), with molecular formula C24H19ClFN9Na2O9S2 and molecular weight 741.02 g/mol. IUPAC: disodium;2-[(5-carbamoyl-1-ethyl-6-hydroxy-4-methyl-2-oxo-3-pyridinyl)diazenyl]-4-[[4-(2-chloro-5-sulfonatoanilino)-6-fluoro-1,3,5-triazin-2-yl]amino]benzenesulfonate.
Chemical Property Profile of Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2)
Property Insights of Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2)
The XLogP value of -3.32258 indicates that Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 302.0 Ų indicates high polarity, suggesting Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2) has 4 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2)?
The CAS number of Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2) is 75268-65-4.
What is the molecular formula of Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2)?
The molecular formula of Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2) is C24H19ClFN9Na2O9S2.
What is the molecular weight of Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2)?
The molecular weight of Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2) is 741.02 g/mol.
Where can I buy Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2)?
You can request a quote for Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2)?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-4-((4-((2-chloro-5-sulfophenyl)amino)-6-fluoro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.