![4-[(2,5-Dimethylphenyl)sulfanyl]aniline structure](/static/products/5609/560998-07-4.webp)
4-[(2,5-Dimethylphenyl)sulfanyl]aniline
TL;DR: 4-[(2,5-Dimethylphenyl)sulfanyl]aniline (CAS 560998-07-4) is a chemical compound with molecular formula C14H15NS and molecular weight 229.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,5-dimethylphenyl)sulfanylaniline
Also Known As: 4-((2,5-DIMETHYLPHENYL)THIO)ANILINE, 4-[(2,5-dimethylphenyl)sulfanyl]aniline, 4-(2,5-dimethylphenyl)sulfanylaniline, 4-(2,5-dimethylphenylthio)phenylamine, Benzenamine, 4-[(2,5-dimethylphenyl)thio]-
| Molecular Formula | C14H15NS |
|---|---|
| Molecular Weight | 229.09 g/mol |
| LogP | 4.03684 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.09251 |
| Heavy Atoms | 16 |
| Complexity | 488.58856 |
Chemical Identifiers
| CAS Number | 560998-07-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)N |
Product Overview
4-[(2,5-Dimethylphenyl)sulfanyl]aniline (CAS 560998-07-4), with molecular formula C14H15NS and molecular weight 229.09 g/mol. IUPAC: 4-(2,5-dimethylphenyl)sulfanylaniline.
Chemical Property Profile of 4-[(2,5-Dimethylphenyl)sulfanyl]aniline
Property Insights of 4-[(2,5-Dimethylphenyl)sulfanyl]aniline
The XLogP value of 4.03684 indicates that 4-[(2,5-Dimethylphenyl)sulfanyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 4-[(2,5-Dimethylphenyl)sulfanyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(2,5-Dimethylphenyl)sulfanyl]aniline has 1 hydrogen bond donor(s) and 2 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-[(2,5-Dimethylphenyl)sulfanyl]aniline?
The CAS number of 4-[(2,5-Dimethylphenyl)sulfanyl]aniline is 560998-07-4.
What is the molecular formula of 4-[(2,5-Dimethylphenyl)sulfanyl]aniline?
The molecular formula of 4-[(2,5-Dimethylphenyl)sulfanyl]aniline is C14H15NS.
What is the molecular weight of 4-[(2,5-Dimethylphenyl)sulfanyl]aniline?
The molecular weight of 4-[(2,5-Dimethylphenyl)sulfanyl]aniline is 229.09 g/mol.
Where can I buy 4-[(2,5-Dimethylphenyl)sulfanyl]aniline?
You can request a quote for 4-[(2,5-Dimethylphenyl)sulfanyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2,5-Dimethylphenyl)sulfanyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2,5-Dimethylphenyl)sulfanyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.