N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide
TL;DR: N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide (CAS 28857-06-9) is a chemical compound with molecular formula C22H22N2O5S and molecular weight 426.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(2-hydroxy-4,6-dimethoxyphenyl)methylideneamino]phenyl]-4-methylbenzenesulfonamide
Also Known As: N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide, N-[2-[[(Z)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene), N-(2-{[(Z)-(2,4-Dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino}phenyl)-4-methylbenzene-1-sulfonamide, N-[2-[(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-methylbenzenesulfonamide, N-[2-[[(E)-(2,4-dimethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methyl-benzenesulfonamide
| Molecular Formula | C22H22N2O5S |
|---|---|
| Molecular Weight | 426.12 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 426.12494 |
| Heavy Atoms | 30 |
| Complexity | 657.0 |
Chemical Identifiers
| CAS Number | 28857-06-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2N=CC3=C(C=C(C=C3OC)OC)O |
| InChIKey | SHRJVGQBKGCULK-UHFFFAOYSA-N |
Product Overview
N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide (CAS 28857-06-9), with molecular formula C22H22N2O5S and molecular weight 426.12 g/mol. IUPAC: N-[2-[(2-hydroxy-4,6-dimethoxyphenyl)methylideneamino]phenyl]-4-methylbenzenesulfonamide.
Chemical Property Profile of N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide
Property Insights of N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide
The XLogP value of 3.7 indicates that N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide?
The CAS number of N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide is 28857-06-9.
What is the molecular formula of N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide?
The molecular formula of N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide is C22H22N2O5S.
What is the molecular weight of N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide?
The molecular weight of N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide is 426.12 g/mol.
Where can I buy N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide?
You can request a quote for N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-[[(E)-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.