RefChem:85433
TL;DR: RefChem:85433 (CAS 75198-92-4) is a chemical compound with molecular formula C28H23ClN6Na2O10S2 and molecular weight 748.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;1-amino-4-[2-[[[4-chloro-6-(2-methoxyethoxy)-1,3,5-triazin-2-yl]amino]methyl]-4-methyl-6-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate
Also Known As: 2-Anthracenesulfonic acid, 1-amino-4-((2-(((4-chloro-6-(2-methoxyethoxy)-1,3,5-triazin-2-yl)amino)methyl)-4-methyl-6-sulfophenyl)amino)-9,10-dihydro-9,10-dioxo-, disodium salt, 1-Amino-4-((2-(((2-chloro-4-(2-methoxyethoxy)-1,3,5-triazin-6-yl)amino)methyl)-4-methyl-6-sulfophenyl)amino)-2-anthraquinonesulfonic acid, disodium salt, 2-Anthracenesulfonic acid, 1-amino-4-((2-(((4-chloro-6-(2-methoxyethoxy)-1,3,5-triazin-2-yl)amino)methyl)-4-methyl-6-sulfophenyl)amino)-9,10-dihydro-9,10-dioxo-, sodium salt (1:2), 2-Anthracenesulfonic acid, 1-amino-4-[[2-[[[4-chloro-6-(2-methoxyethoxy)-1,3,5-triazin-2-yl]amino]methyl]-4-methyl-6-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-, disodium salt, 2-Anthracenesulfonic acid, 1-amino-4-[[2-[[[4-chloro-6-(2-methoxyethoxy)-1,3,5-triazin-2-yl]amino]methyl]-4-methyl-6-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-, sodium salt (1:2)
| Molecular Formula | C28H23ClN6Na2O10S2 |
|---|---|
| Molecular Weight | 748.04 g/mol |
| LogP | -3.61188 |
| Topological Polar Surface Area | 273.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 9 |
| Exact Mass | 748.0401 |
| Heavy Atoms | 49 |
| Complexity | 1320.0 |
Chemical Identifiers
| CAS Number | 75198-92-4 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)S(=O)(=O)[O-])NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])CNC5=NC(=NC(=N5)Cl)OCCOC.[Na+].[Na+] |
| InChIKey | PICWZTBMIQPVRH-UHFFFAOYSA-L |
Product Overview
RefChem:85433 (CAS 75198-92-4), with molecular formula C28H23ClN6Na2O10S2 and molecular weight 748.04 g/mol. IUPAC: disodium;1-amino-4-[2-[[[4-chloro-6-(2-methoxyethoxy)-1,3,5-triazin-2-yl]amino]methyl]-4-methyl-6-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate.
Chemical Property Profile of RefChem:85433
Property Insights of RefChem:85433
The XLogP value of -3.61188 indicates that RefChem:85433 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 273.0 Ų indicates high polarity, suggesting RefChem:85433 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:85433 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 RefChem:85433?
The CAS number of RefChem:85433 is 75198-92-4.
What is the molecular formula of RefChem:85433?
The molecular formula of RefChem:85433 is C28H23ClN6Na2O10S2.
What is the molecular weight of RefChem:85433?
The molecular weight of RefChem:85433 is 748.04 g/mol.
Where can I buy RefChem:85433?
You can request a quote for RefChem:85433 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:85433?
Yes, KEHONG BIO provides custom synthesis services for RefChem:85433 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.