4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)-
TL;DR: 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)- (CAS 49579-44-4) is a chemical compound with molecular formula C16H13FN2S and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluoro-2-methyl-3-(4-methylphenyl)quinazoline-4-thione
Also Known As: 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)-, 5-24-03-00225 (Beilstein Handbook Reference), 6-Fluoro-2-methyl-3-(4-methylphenyl)-4(3H)-quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)quinazoline-4-thione, 6-Fluoro-2-methyl-3-(4-methylphenyl)quinazoline-4(3H)-thione
| Molecular Formula | C16H13FN2S |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 47.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 284.07834 |
| Heavy Atoms | 20 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 49579-44-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NC3=C(C2=S)C=C(C=C3)F)C |
| InChIKey | FQMJDSYOJXXPOA-UHFFFAOYSA-N |
Product Overview
4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)- (CAS 49579-44-4), with molecular formula C16H13FN2S and molecular weight 284.08 g/mol. IUPAC: 6-fluoro-2-methyl-3-(4-methylphenyl)quinazoline-4-thione.
Chemical Property Profile of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)-
Property Insights of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)-
The XLogP value of 3.5 indicates that 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.7 Ų, 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)- has 0 hydrogen bond donor(s) and 3 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, 6-fluoro-2-methyl-3-(4-methylphenyl)-?
The CAS number of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)- is 49579-44-4.
What is the molecular formula of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)-?
The molecular formula of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)- is C16H13FN2S.
What is the molecular weight of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)-?
The molecular weight of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)- is 284.08 g/mol.
Where can I buy 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)-?
You can request a quote for 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)- 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, 6-fluoro-2-methyl-3-(4-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.