![N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide structure](/static/products/7066/7066-52-6.webp)
N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide
TL;DR: N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide (CAS 7066-52-6) is a chemical compound with molecular formula C31H38N2O5S and molecular weight 550.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy-2-methyl-4-oxo-5-propan-2-ylcyclohexa-2,5-dien-1-ylidene]-4-methylbenzenesulfonamide
Also Known As: N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide, N-[3-[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy-2-methyl-4-oxo-5-propan-2-ylcyclohexa-2,5-dien-1-ylidene]-4-methylbenzenesulfonamide
| Molecular Formula | C31H38N2O5S |
|---|---|
| Molecular Weight | 550.25 g/mol |
| LogP | 6.46412 |
| Topological Polar Surface Area | 102.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 550.2501 |
| Heavy Atoms | 39 |
| Complexity | 1463.4535 |
Chemical Identifiers
| CAS Number | 7066-52-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N=C2C=C(C(=O)C(=C2C)ON=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C(C)C |
Product Overview
N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide (CAS 7066-52-6), with molecular formula C31H38N2O5S and molecular weight 550.25 g/mol. IUPAC: N-[3-[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy-2-methyl-4-oxo-5-propan-2-ylcyclohexa-2,5-dien-1-ylidene]-4-methylbenzenesulfonamide.
Chemical Property Profile of N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide
Property Insights of N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide
The XLogP value of 6.46412 indicates that N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide. Following Lipinski's Rule of Five, N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide?
The CAS number of N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide is 7066-52-6.
What is the molecular formula of N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide?
The molecular formula of N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide is C31H38N2O5S.
What is the molecular weight of N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide?
The molecular weight of N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide is 550.25 g/mol.
Where can I buy N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide?
You can request a quote for N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-{[(3,5-Di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]oxy}-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]-4-methylbenzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.