![2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline structure](/static/products/4778/477845-79-7.webp)
2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline
TL;DR: 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline (CAS 477845-79-7) is a chemical compound with molecular formula C16H11F3N2OS and molecular weight 336.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-4-[3-(trifluoromethyl)phenoxy]quinazoline
Also Known As: 2-(methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline, 10N-654S, 2-methylsulfanyl-4-[3-(trifluoromethyl)phenoxy]quinazoline
| Molecular Formula | C16H11F3N2OS |
|---|---|
| Molecular Weight | 336.05 g/mol |
| LogP | 5.1628 |
| Topological Polar Surface Area | 35.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.0544 |
| Heavy Atoms | 23 |
| Complexity | 852.0932 |
Chemical Identifiers
| CAS Number | 477845-79-7 |
|---|---|
| SMILES | CSC1=NC2=CC=CC=C2C(=N1)OC3=CC=CC(=C3)C(F)(F)F |
Product Overview
2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline (CAS 477845-79-7), with molecular formula C16H11F3N2OS and molecular weight 336.05 g/mol. IUPAC: 2-methylsulfanyl-4-[3-(trifluoromethyl)phenoxy]quinazoline.
Chemical Property Profile of 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline
Property Insights of 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline
The XLogP value of 5.1628 indicates that 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.01 Ų, 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline?
The CAS number of 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline is 477845-79-7.
What is the molecular formula of 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline?
The molecular formula of 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline is C16H11F3N2OS.
What is the molecular weight of 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline?
The molecular weight of 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline is 336.05 g/mol.
Where can I buy 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline?
You can request a quote for 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylsulfanyl)-4-[3-(trifluoromethyl)phenoxy]quinazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.