CTK8J7461
TL;DR: CTK8J7461 (CAS 63543-86-2) is a chemical compound with molecular formula C35H25N6Na3O12S3 and molecular weight 886.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;2-[4-[2-[4-[[1-(2-methoxyanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-sulfonatophenyl]ethenyl]-3-sulfonatophenyl]benzo[e]benzotriazole-5-sulfonate
Also Known As: Phosphinous acid,diphenyl-,1-methylheptyl ester, 2H-Naphtho[1,2-d]triazole-5-sulfonic acid, 2-[4-[2-[4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]-2-sulfophenyl]ethenyl]-3-sulfophenyl]-, trisodium salt, 2H-Naphtho[1,2-d]triazole-5-sulfonic acid, 2-[4-[2-[4-[2-[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]diazenyl]-2-sulfophenyl]ethenyl]-3-sulfophenyl]-, sodium salt (1:3), Trisodium 2-{4-[2-(4-{[1-(2-methoxyanilino)-1,3-dioxobutan-2-yl]diazenyl}-2-sulfonatophenyl)ethen-1-yl]-3-sulfonatophenyl}-2H-naphtho[1,2-d][1,2,3]triazole-5-sulfonate, trisodium,2-[4-[(E)-2-[4-[[1-(2-methoxyanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-sulfonatophenyl]ethenyl]-3-sulfonatophenyl]benzo[e]benzotriazole-5-sulfonate
| Molecular Formula | C35H25N6Na3O12S3 |
|---|---|
| Molecular Weight | 886.04 g/mol |
| LogP | -4.843 |
| Topological Polar Surface Area | 308.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 9 |
| Exact Mass | 886.0386 |
| Heavy Atoms | 59 |
| Complexity | 1770.0 |
Chemical Identifiers
| CAS Number | 63543-86-2 |
|---|---|
| SMILES | CC(=O)C(C(=O)NC1=CC=CC=C1OC)N=NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)N4N=C5C=C(C6=CC=CC=C6C5=N4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChIKey | ZLYCTBKZFLWFEV-UHFFFAOYSA-K |
Product Overview
CTK8J7461 (CAS 63543-86-2), with molecular formula C35H25N6Na3O12S3 and molecular weight 886.04 g/mol. IUPAC: trisodium;2-[4-[2-[4-[[1-(2-methoxyanilino)-1,3-dioxobutan-2-yl]diazenyl]-2-sulfonatophenyl]ethenyl]-3-sulfonatophenyl]benzo[e]benzotriazole-5-sulfonate.
Chemical Property Profile of CTK8J7461
Property Insights of CTK8J7461
The XLogP value of -4.843 indicates that CTK8J7461 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 308.0 Ų indicates high polarity, suggesting CTK8J7461 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK8J7461 has 1 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 CTK8J7461?
The CAS number of CTK8J7461 is 63543-86-2.
What is the molecular formula of CTK8J7461?
The molecular formula of CTK8J7461 is C35H25N6Na3O12S3.
What is the molecular weight of CTK8J7461?
The molecular weight of CTK8J7461 is 886.04 g/mol.
Where can I buy CTK8J7461?
You can request a quote for CTK8J7461 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK8J7461?
Yes, KEHONG BIO provides custom synthesis services for CTK8J7461 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.