CTK5B5946
TL;DR: CTK5B5946 (CAS 6276-96-6) is a chemical compound with molecular formula C36H24N4O12S2 and molecular weight 768.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-[2-[4-[(3-carboxy-2-hydroxynaphthalen-1-yl)diazenyl]-2-sulfophenyl]ethenyl]-3-sulfophenyl]diazenyl]-3-hydroxynaphthalene-2-carboxylic acid
Also Known As: 4-((4-(2-(4-((3-Carboxy-2-hydroxy-1-naphthyl)diazenyl)-2-sulfophenyl)vinyl)-3-sulfophenyl)diazenyl)-3-hydroxy-2-naphthoic acid
| Molecular Formula | C36H24N4O12S2 |
|---|---|
| Molecular Weight | 768.08 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 290.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 768.0832 |
| Heavy Atoms | 54 |
| Complexity | 1540.0 |
Chemical Identifiers
| CAS Number | 6276-96-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=C2N=NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)N=NC5=C(C(=CC6=CC=CC=C65)C(=O)O)O)S(=O)(=O)O)S(=O)(=O)O)O)C(=O)O |
| InChIKey | BDXUBDHCCBUMEP-UHFFFAOYSA-N |
Product Overview
CTK5B5946 (CAS 6276-96-6), with molecular formula C36H24N4O12S2 and molecular weight 768.08 g/mol. IUPAC: 4-[[4-[2-[4-[(3-carboxy-2-hydroxynaphthalen-1-yl)diazenyl]-2-sulfophenyl]ethenyl]-3-sulfophenyl]diazenyl]-3-hydroxynaphthalene-2-carboxylic acid.
Chemical Property Profile of CTK5B5946
Property Insights of CTK5B5946
The XLogP value of 7.2 indicates that CTK5B5946 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 290.0 Ų indicates high polarity, suggesting CTK5B5946 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK5B5946 has 6 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 CTK5B5946?
The CAS number of CTK5B5946 is 6276-96-6.
What is the molecular formula of CTK5B5946?
The molecular formula of CTK5B5946 is C36H24N4O12S2.
What is the molecular weight of CTK5B5946?
The molecular weight of CTK5B5946 is 768.08 g/mol.
Where can I buy CTK5B5946?
You can request a quote for CTK5B5946 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5B5946?
Yes, KEHONG BIO provides custom synthesis services for CTK5B5946 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.