4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide]
TL;DR: 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide] (CAS 6949-71-9) is a chemical compound with molecular formula C28H22N6O6S2 and molecular weight 602.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3,6-dioxo-4-[4-(pyridin-2-ylsulfamoyl)anilino]cyclohexa-1,4-dien-1-yl]amino]-N-pyridin-2-ylbenzenesulfonamide
Also Known As: 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide], 4-[[3,6-dioxo-4-[4-(pyridin-2-ylsulfamoyl)anilino]cyclohexa-1,4-dien-1-yl]amino]-N-pyridin-2-ylbenzenesulfonamide, 4,4'-[(3,6-Dioxocyclohexa-1,4-diene-1,4-diyl)bis(azanediyl)]bis[N-(pyridin-2-yl)benzene-1-sulfonamide], 4,4'-[(3,6-Dioxocyclohexa-1,4-diene-1,4-diyl)diazanediyl]bis[N-(pyridin-2-yl)benzene-1-sulfonamide]
| Molecular Formula | C28H22N6O6S2 |
|---|---|
| Molecular Weight | 602.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 193.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 602.10425 |
| Heavy Atoms | 42 |
| Complexity | 1160.0 |
Chemical Identifiers
| CAS Number | 6949-71-9 |
|---|---|
| SMILES | C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC3=CC(=O)C(=CC3=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=CC=CC=N5 |
| InChIKey | KICGQQCQKASMPS-UHFFFAOYSA-N |
Product Overview
4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide] (CAS 6949-71-9), with molecular formula C28H22N6O6S2 and molecular weight 602.10 g/mol. IUPAC: 4-[[3,6-dioxo-4-[4-(pyridin-2-ylsulfamoyl)anilino]cyclohexa-1,4-dien-1-yl]amino]-N-pyridin-2-ylbenzenesulfonamide.
Chemical Property Profile of 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide]
Property Insights of 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide]
The XLogP value of 3.1 indicates that 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 193.0 Ų indicates high polarity, suggesting 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide] may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide] has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide]?
The CAS number of 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide] is 6949-71-9.
What is the molecular formula of 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide]?
The molecular formula of 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide] is C28H22N6O6S2.
What is the molecular weight of 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide]?
The molecular weight of 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide] is 602.10 g/mol.
Where can I buy 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide]?
You can request a quote for 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide]?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-[(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)diimino]bis[n-(pyridin-2-yl)benzenesulfonamide] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.