CTK9A2486
TL;DR: CTK9A2486 (CAS 72139-03-8) is a chemical compound with molecular formula C24H16N8O12S2 and molecular weight 672.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2-[[5-[(4-nitrophenyl)hydrazinylidene]-4,6-dioxo-3-[(4-sulfophenyl)hydrazinylidene]cyclohexen-1-yl]diazenyl]benzenesulfonic acid
Also Known As: Benzenesulfonic acid, 2-[[2,4-dihydroxy-3-[(4-nitrophenyl)azo]-5-[(4-sulfophenyl)azo]phenyl]azo]-5-nitro-, 5-nitro-2-[[(3E,5Z)-5-[(4-nitrophenyl)hydrazinylidene]-4,6-dioxo-3-[(4-sulfophenyl)hydrazinylidene]cyclohexen-1-yl]diazenyl]benzenesulfonic acid, Benzenesulfonic acid, 2-((2,4-dihydroxy-3-((4-nitrophenyl)azo)-5-((4-sulfophenyl)azo)phenyl)azo)-5-nitro-, Benzenesulfonic acid, 2-(2-(2,4-dihydroxy-3-(2-(4-nitrophenyl)diazenyl)-5-(2-(4-sulfophenyl)diazenyl)phenyl)diazenyl)-5-nitro-
| Molecular Formula | C24H16N8O12S2 |
|---|---|
| Molecular Weight | 672.03 g/mol |
| LogP | 1.8634 |
| Topological Polar Surface Area | 302.66 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 672.0329 |
| Heavy Atoms | 46 |
| Complexity | 2353.825 |
Chemical Identifiers
| CAS Number | 72139-03-8 |
|---|---|
| SMILES | C1=CC(=CC=C1NN=C2C(=O)C(=CC(=NNC3=CC=C(C=C3)S(=O)(=O)O)C2=O)N=NC4=C(C=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-] |
Product Overview
CTK9A2486 (CAS 72139-03-8), with molecular formula C24H16N8O12S2 and molecular weight 672.03 g/mol. IUPAC: 5-nitro-2-[[5-[(4-nitrophenyl)hydrazinylidene]-4,6-dioxo-3-[(4-sulfophenyl)hydrazinylidene]cyclohexen-1-yl]diazenyl]benzenesulfonic acid.
Chemical Property Profile of CTK9A2486
Property Insights of CTK9A2486
The XLogP value of 1.8634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK9A2486. The TPSA of 302.66 Ų indicates high polarity, suggesting CTK9A2486 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK9A2486 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 CTK9A2486?
The CAS number of CTK9A2486 is 72139-03-8.
What is the molecular formula of CTK9A2486?
The molecular formula of CTK9A2486 is C24H16N8O12S2.
What is the molecular weight of CTK9A2486?
The molecular weight of CTK9A2486 is 672.03 g/mol.
Where can I buy CTK9A2486?
You can request a quote for CTK9A2486 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK9A2486?
Yes, KEHONG BIO provides custom synthesis services for CTK9A2486 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.