![4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL structure](/static/products/4339/433941-92-5.webp)
4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL
TL;DR: 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL (CAS 433941-92-5) is a chemical compound with molecular formula C22H20N2O4S and molecular weight 408.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(N-(1,1-dioxo-1,2-benzothiazol-3-yl)-4-methylanilino)methyl]-2-methoxyphenol
Also Known As: 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL, 4-([(1,1-Dioxido-1,2-benzisothiazol-3-yl)(4-methylphenyl)amino]methyl)-2-methoxyphenol, AM-879/41047200, 4-[(N-(1,1-dioxo-1,2-benzothiazol-3-yl)-4-methylanilino)methyl]-2-methoxyphenol, 3-((4-Hydroxy-3-methoxybenzyl)(p-tolyl)amino)benzo[d]isothiazole 1,1-dioxide
| Molecular Formula | C22H20N2O4S |
|---|---|
| Molecular Weight | 408.11 g/mol |
| LogP | 3.86492 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.11438 |
| Heavy Atoms | 29 |
| Complexity | 1201.7368 |
Chemical Identifiers
| CAS Number | 433941-92-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N(CC2=CC(=C(C=C2)O)OC)C3=NS(=O)(=O)C4=CC=CC=C43 |
Product Overview
4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL (CAS 433941-92-5), with molecular formula C22H20N2O4S and molecular weight 408.11 g/mol. IUPAC: 4-[(N-(1,1-dioxo-1,2-benzothiazol-3-yl)-4-methylanilino)methyl]-2-methoxyphenol.
Chemical Property Profile of 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL
Property Insights of 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL
The XLogP value of 3.86492 indicates that 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL. Following Lipinski's Rule of Five, 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL has 1 hydrogen bond donor(s) and 5 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 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL?
The CAS number of 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL is 433941-92-5.
What is the molecular formula of 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL?
The molecular formula of 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL is C22H20N2O4S.
What is the molecular weight of 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL?
The molecular weight of 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL is 408.11 g/mol.
Where can I buy 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL?
You can request a quote for 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(1,1-DIOXIDO-1,2-BENZISOTHIAZOL-3-YL)(4-METHYLPHENYL)AMINO]METHYL}-2-METHOXYPHENOL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.