CTK5F5564
TL;DR: CTK5F5564 (CAS 85711-23-5) is a chemical compound with molecular formula C30H22N6O12S3 and molecular weight 754.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-amino-4-[(5-sulfonaphthalen-1-yl)diazenyl]phenyl]imino-[4-[2-(4-nitro-2-sulfophenyl)ethenyl]-3-sulfophenyl]-oxidoazanium
Also Known As: 1-Naphthalenesulfonicacid,5-[[2-amino-4-[[4-[2-(4-nitro-2-sulfophenyl)ethenyl]-3-sulfophenyl]azoxy]phenyl]azo]-(9CI)
| Molecular Formula | C30H22N6O12S3 |
|---|---|
| Molecular Weight | 754.05 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 326.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 9 |
| Exact Mass | 754.0458 |
| Heavy Atoms | 51 |
| Complexity | 1670.0 |
Chemical Identifiers
| CAS Number | 85711-23-5 |
|---|---|
| SMILES | C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)N=NC3=C(C=C(C=C3)N=[N+](C4=CC(=C(C=C4)C=CC5=C(C=C(C=C5)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)[O-])N |
| InChIKey | YYBNEILVLHWBSA-UHFFFAOYSA-N |
Product Overview
CTK5F5564 (CAS 85711-23-5), with molecular formula C30H22N6O12S3 and molecular weight 754.05 g/mol. IUPAC: [3-amino-4-[(5-sulfonaphthalen-1-yl)diazenyl]phenyl]imino-[4-[2-(4-nitro-2-sulfophenyl)ethenyl]-3-sulfophenyl]-oxidoazanium.
Chemical Property Profile of CTK5F5564
Property Insights of CTK5F5564
The XLogP value of 3.8 indicates that CTK5F5564 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 326.0 Ų indicates high polarity, suggesting CTK5F5564 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK5F5564 has 4 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 CTK5F5564?
The CAS number of CTK5F5564 is 85711-23-5.
What is the molecular formula of CTK5F5564?
The molecular formula of CTK5F5564 is C30H22N6O12S3.
What is the molecular weight of CTK5F5564?
The molecular weight of CTK5F5564 is 754.05 g/mol.
Where can I buy CTK5F5564?
You can request a quote for CTK5F5564 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5F5564?
Yes, KEHONG BIO provides custom synthesis services for CTK5F5564 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.