1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt
TL;DR: 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt (CAS 71002-15-8) is a chemical compound with molecular formula C33H37ClN8Na2O10S2 and molecular weight 850.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;4-[(5-carbamoyl-1-ethyl-6-hydroxy-4-methyl-2-oxo-3-pyridinyl)diazenyl]-6-[[4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl]amino]benzene-1,3-disulfonate
Also Known As: 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt, 1,3-Benzenedisulfonic acid, 4-(2-(5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)diazenyl)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, sodium salt (1:2), 1,3-Benzenedisulfonic acid, 4-[[5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl]azo]-6-[[4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl]amino]-, disodium salt, 1,3-Benzenedisulfonic acid, 4-[2-[5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl]diazenyl]-6-[[4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl]amino]-, sodium salt (1:2), 4-((4-Chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-6-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-1,3-benzenedisulfonic acid, disodium salt
| Molecular Formula | C33H37ClN8Na2O10S2 |
|---|---|
| Molecular Weight | 850.16 g/mol |
| LogP | -0.11988 |
| Topological Polar Surface Area | 299.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 16 |
| Exact Mass | 850.1558 |
| Heavy Atoms | 56 |
| Complexity | 1600.0 |
Chemical Identifiers
| CAS Number | 71002-15-8 |
|---|---|
| SMILES | CCCCCCCCCC1=CC=C(C=C1)OC2=NC(=NC(=N2)NC3=CC(=C(C=C3S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC4=C(C(=C(N(C4=O)CC)O)C(=O)N)C)Cl.[Na+].[Na+] |
| InChIKey | MNVMZZHRFVDYFX-UHFFFAOYSA-L |
Product Overview
1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt (CAS 71002-15-8), with molecular formula C33H37ClN8Na2O10S2 and molecular weight 850.16 g/mol. IUPAC: disodium;4-[(5-carbamoyl-1-ethyl-6-hydroxy-4-methyl-2-oxo-3-pyridinyl)diazenyl]-6-[[4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl]amino]benzene-1,3-disulfonate.
Chemical Property Profile of 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt
Property Insights of 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt
The XLogP value of -0.11988 indicates that 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 299.0 Ų indicates high polarity, suggesting 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt has 3 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 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt?
The CAS number of 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt is 71002-15-8.
What is the molecular formula of 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt?
The molecular formula of 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt is C33H37ClN8Na2O10S2.
What is the molecular weight of 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt?
The molecular weight of 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt is 850.16 g/mol.
Where can I buy 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt?
You can request a quote for 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenedisulfonic acid, 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)-, disodium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.