![N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline structure](/static/products/498/498534-99-9.png)
N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline
TL;DR: N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline (CAS 498534-99-9) is a chemical compound with molecular formula C13H15N3OS and molecular weight 261.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methoxyaniline
Also Known As: N-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methoxyaniline, N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline, S-(4,6-dimethylpyrimidin-2-yl)-N-(2-methoxyphenyl)thiohydroxylamine
| Molecular Formula | C13H15N3OS |
|---|---|
| Molecular Weight | 261.09 g/mol |
| LogP | 3.22124 |
| Topological Polar Surface Area | 47.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.0936 |
| Heavy Atoms | 18 |
| Complexity | 525.2596 |
Chemical Identifiers
| CAS Number | 498534-99-9 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)SNC2=CC=CC=C2OC)C |
Product Overview
N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline (CAS 498534-99-9), with molecular formula C13H15N3OS and molecular weight 261.09 g/mol. IUPAC: N-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methoxyaniline.
Chemical Property Profile of N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline
Property Insights of N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline
The XLogP value of 3.22124 indicates that N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.04 Ų, N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline 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 N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline?
The CAS number of N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline is 498534-99-9.
What is the molecular formula of N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline?
The molecular formula of N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline is C13H15N3OS.
What is the molecular weight of N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline?
The molecular weight of N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline is 261.09 g/mol.
Where can I buy N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline?
You can request a quote for N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.