![N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline structure](/static/products/969/96995-36-7.png)
N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline
TL;DR: N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline (CAS 96995-36-7) is a chemical compound with molecular formula C16H17NOS and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline
Also Known As: N-[mesityl(sulfinyl)methyl]-N-phenylamine, N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline, AB-131/25126062
| Molecular Formula | C16H17NOS |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | 3.41496 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.1031 |
| Heavy Atoms | 19 |
| Complexity | 620.0485 |
Chemical Identifiers
| CAS Number | 96995-36-7 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)C(=S=O)NC2=CC=CC=C2)C |
Product Overview
N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline (CAS 96995-36-7), with molecular formula C16H17NOS and molecular weight 271.10 g/mol. IUPAC: N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline.
Chemical Property Profile of N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline
Property Insights of N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline
The XLogP value of 3.41496 indicates that N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline has 1 hydrogen bond donor(s) and 1 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-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline?
The CAS number of N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline is 96995-36-7.
What is the molecular formula of N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline?
The molecular formula of N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline is C16H17NOS.
What is the molecular weight of N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline?
The molecular weight of N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline is 271.10 g/mol.
Where can I buy N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline?
You can request a quote for N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for N-[sulfinyl-(2,4,6-trimethylphenyl)methyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.