4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether
TL;DR: 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether (CAS 477845-95-7) is a chemical compound with molecular formula C19H20N2OS and molecular weight 324.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-tert-butylphenoxy)-2-methylsulfanylquinazoline
Also Known As: 10N-675S, 4-(4-tert-butylphenoxy)-2-methylsulfanylquinazoline, 4-(4-tert-butylphenoxy)-2-(methylsulfanyl)quinazoline, 4-(tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether
| Molecular Formula | C19H20N2OS |
|---|---|
| Molecular Weight | 324.13 g/mol |
| LogP | 5.4415 |
| Topological Polar Surface Area | 35.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.12964 |
| Heavy Atoms | 23 |
| Complexity | 822.8875 |
Chemical Identifiers
| CAS Number | 477845-95-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OC2=NC(=NC3=CC=CC=C32)SC |
Product Overview
4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether (CAS 477845-95-7), with molecular formula C19H20N2OS and molecular weight 324.13 g/mol. IUPAC: 4-(4-tert-butylphenoxy)-2-methylsulfanylquinazoline.
Chemical Property Profile of 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether
Property Insights of 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether
The XLogP value of 5.4415 indicates that 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.01 Ų, 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether 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 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether?
The CAS number of 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether is 477845-95-7.
What is the molecular formula of 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether?
The molecular formula of 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether is C19H20N2OS.
What is the molecular weight of 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether?
The molecular weight of 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether is 324.13 g/mol.
Where can I buy 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether?
You can request a quote for 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether?
Yes, KEHONG BIO provides custom synthesis services for 4-(Tert-butyl)phenyl 2-(methylsulfanyl)-4-quinazolinyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.