4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl-
TL;DR: 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl- (CAS 49579-46-6) is a chemical compound with molecular formula C17H15FN2OS and molecular weight 314.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-ethoxyphenyl)-6-fluoro-2-methylquinazoline-4-thione
Also Known As: 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl-, 5-24-03-00226 (Beilstein Handbook Reference), 3-(4-Ethoxyphenyl)-6-fluoro-2-methyl-4(3H)-quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methylquinazoline-4-thione, 3-(4-ethoxyphenyl)-6-fluoro-2-methylquinazoline-4(3H)-thione
| Molecular Formula | C17H15FN2OS |
|---|---|
| Molecular Weight | 314.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 56.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.0889 |
| Heavy Atoms | 22 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 49579-46-6 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NC3=C(C2=S)C=C(C=C3)F)C |
| InChIKey | MRCQTILLIQJURY-UHFFFAOYSA-N |
Product Overview
4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl- (CAS 49579-46-6), with molecular formula C17H15FN2OS and molecular weight 314.09 g/mol. IUPAC: 3-(4-ethoxyphenyl)-6-fluoro-2-methylquinazoline-4-thione.
Chemical Property Profile of 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl-
Property Insights of 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl-
The XLogP value of 3.5 indicates that 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.9 Ų, 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl- has 0 hydrogen bond donor(s) and 4 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(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl-?
The CAS number of 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl- is 49579-46-6.
What is the molecular formula of 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl-?
The molecular formula of 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl- is C17H15FN2OS.
What is the molecular weight of 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl-?
The molecular weight of 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl- is 314.09 g/mol.
Where can I buy 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl-?
You can request a quote for 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinethione, 3-(4-ethoxyphenyl)-6-fluoro-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.