CTK4I2816
TL;DR: CTK4I2816 (CAS 4028-32-4) is a chemical compound with molecular formula C28H30Cl2N10Na2O10S2 and molecular weight 846.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;5-[[4-[bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]-2-[2-[4-[[4-[bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]-2-sulfonatophenyl]ethenyl]benzenesulfonate
Also Known As: Benzenesulfonic acid,2,2'-(1,2-ethenediyl)bis[5-[[4-[bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]-,sodium salt (1:2), Disodium 2,2'-(ethene-1,2-diyl)bis[5-({4-[bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl}amino)benzene-1-sulfonate], Disodium 4,4'-bis((4-(bis(2-hydroxyethyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)stilbene-2,2'-disulphonate
| Molecular Formula | C28H30Cl2N10Na2O10S2 |
|---|---|
| Molecular Weight | 846.08 g/mol |
| LogP | -5.5808 |
| Topological Polar Surface Area | 320.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 16 |
| Exact Mass | 846.07605 |
| Heavy Atoms | 54 |
| Complexity | 1200.0 |
Chemical Identifiers
| CAS Number | 4028-32-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC2=NC(=NC(=N2)Cl)N(CCO)CCO)S(=O)(=O)[O-])C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)Cl)N(CCO)CCO)S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | HAHRMQHHDYEVCF-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CTK4I2816 (CAS 4028-32-4), with molecular formula C28H30Cl2N10Na2O10S2 and molecular weight 846.08 g/mol. IUPAC: disodium;5-[[4-[bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]-2-[2-[4-[[4-[bis(2-hydroxyethyl)amino]-6-chloro-1,3,5-triazin-2-yl]amino]-2-sulfonatophenyl]ethenyl]benzenesulfonate.
Chemical Property Profile of CTK4I2816
Property Insights of CTK4I2816
The XLogP value of -5.5808 indicates that CTK4I2816 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 320.0 Ų indicates high polarity, suggesting CTK4I2816 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK4I2816 has 6 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK4I2816?
The CAS number of CTK4I2816 is 4028-32-4.
What is the molecular formula of CTK4I2816?
The molecular formula of CTK4I2816 is C28H30Cl2N10Na2O10S2.
What is the molecular weight of CTK4I2816?
The molecular weight of CTK4I2816 is 846.08 g/mol.
Where can I buy CTK4I2816?
You can request a quote for CTK4I2816 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4I2816?
Yes, KEHONG BIO provides custom synthesis services for CTK4I2816 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.