![2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol structure](/static/products/4168/416862-08-3.webp)
2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol
TL;DR: 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol (CAS 416862-08-3) is a chemical compound with molecular formula C16H19NO3S and molecular weight 305.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol
Also Known As: BAS 02500300, 2,6-dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol, 2,6-dimethoxy-4-{[3-(methylsulfanyl)anilino]methyl}phenol, 2,6-dimethoxy-4-({[3-(methylsulfanyl)phenyl]amino}methyl)phenol, 2,6-dimethoxy-4-{[(3-methylthiophenyl)amino]methyl}phenol
| Molecular Formula | C16H19NO3S |
|---|---|
| Molecular Weight | 305.11 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 305.10855 |
| Heavy Atoms | 21 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 416862-08-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)CNC2=CC(=CC=C2)SC |
| InChIKey | GTLPTWZRVXPARA-UHFFFAOYSA-N |
Product Overview
2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol (CAS 416862-08-3), with molecular formula C16H19NO3S and molecular weight 305.11 g/mol. IUPAC: 2,6-dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol.
Chemical Property Profile of 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol
Property Insights of 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol
The XLogP value of 3.5 indicates that 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol. Following Lipinski's Rule of Five, 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol has 2 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 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol?
The CAS number of 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol is 416862-08-3.
What is the molecular formula of 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol?
The molecular formula of 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol is C16H19NO3S.
What is the molecular weight of 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol?
The molecular weight of 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol is 305.11 g/mol.
Where can I buy 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol?
You can request a quote for 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethoxy-4-[(3-methylsulfanylanilino)methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.