4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)-
TL;DR: 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)- (CAS 49579-50-2) is a chemical compound with molecular formula C15H10FN3O2S and molecular weight 315.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluoro-2-methyl-3-(4-nitrophenyl)quinazoline-4-thione
Also Known As: 6-Fluoro-2-methyl-3-(4-nitrophenyl)-4(3H)-quinazolinethione, 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)-, 5-24-03-00225 (Beilstein Handbook Reference), 6-fluoro-2-methyl-3-(4-nitrophenyl)quinazoline-4-thione, 4(3H)-Quinazolinethione,6-fluoro-2-methyl-3-(4-nitrophenyl)
| Molecular Formula | C15H10FN3O2S |
|---|---|
| Molecular Weight | 315.05 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 93.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 315.0478 |
| Heavy Atoms | 22 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 49579-50-2 |
|---|---|
| SMILES | CC1=NC2=C(C=C(C=C2)F)C(=S)N1C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | DQIOKFNGYHZSBD-UHFFFAOYSA-N |
Product Overview
4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)- (CAS 49579-50-2), with molecular formula C15H10FN3O2S and molecular weight 315.05 g/mol. IUPAC: 6-fluoro-2-methyl-3-(4-nitrophenyl)quinazoline-4-thione.
Chemical Property Profile of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)-
Property Insights of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)-
The XLogP value of 3.0 indicates that 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)-. Following Lipinski's Rule of Five, 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)- has 0 hydrogen bond donor(s) and 5 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-nitrophenyl)-?
The CAS number of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)- is 49579-50-2.
What is the molecular formula of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)-?
The molecular formula of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)- is C15H10FN3O2S.
What is the molecular weight of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)-?
The molecular weight of 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)- is 315.05 g/mol.
Where can I buy 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)-?
You can request a quote for 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)- 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-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinethione, 6-fluoro-2-methyl-3-(4-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.