CTK4I6152
TL;DR: CTK4I6152 (CAS 42380-62-1) is a chemical compound with molecular formula C28H18Cl2Na2O6S2 and molecular weight 629.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2-chloro-5-[2-[4-[4-[2-(4-chloro-3-sulfonatophenyl)ethenyl]phenyl]phenyl]ethenyl]benzenesulfonate
Also Known As: Benzenesulfonic acid, 3,3'-([1,1'-biphenyl]-4,4'-diyldi-2,1-ethenediyl)bis[6-chloro-, disodium salt, Benzenesulfonic acid,3,3'-([1,1'-biphenyl]-4,4'-diyldi-2,1-ethenediyl)bis[6-chloro-, sodium salt(1:2), Disodium 3,3'-[[1,1'-biphenyl]-4,4'-diyldi(ethene-2,1-diyl)]bis(6-chlorobenzene-1-sulfonate)
| Molecular Formula | C28H18Cl2Na2O6S2 |
|---|---|
| Molecular Weight | 629.97 g/mol |
| LogP | 0.8174 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 629.97174 |
| Heavy Atoms | 40 |
| Complexity | 922.0 |
Chemical Identifiers
| CAS Number | 42380-62-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C=CC2=CC(=C(C=C2)Cl)S(=O)(=O)[O-])C3=CC=C(C=C3)C=CC4=CC(=C(C=C4)Cl)S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | JVLGFGGGZCGQDJ-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CTK4I6152 (CAS 42380-62-1), with molecular formula C28H18Cl2Na2O6S2 and molecular weight 629.97 g/mol. IUPAC: disodium;2-chloro-5-[2-[4-[4-[2-(4-chloro-3-sulfonatophenyl)ethenyl]phenyl]phenyl]ethenyl]benzenesulfonate.
Chemical Property Profile of CTK4I6152
Property Insights of CTK4I6152
The XLogP value of 0.8174 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK4I6152. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4I6152. Following Lipinski's Rule of Five, CTK4I6152 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK4I6152?
The CAS number of CTK4I6152 is 42380-62-1.
What is the molecular formula of CTK4I6152?
The molecular formula of CTK4I6152 is C28H18Cl2Na2O6S2.
What is the molecular weight of CTK4I6152?
The molecular weight of CTK4I6152 is 629.97 g/mol.
Where can I buy CTK4I6152?
You can request a quote for CTK4I6152 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4I6152?
Yes, KEHONG BIO provides custom synthesis services for CTK4I6152 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.