4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)-
TL;DR: 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)- (CAS 340-49-8) is a chemical compound with molecular formula C16H11F3N2O and molecular weight 304.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-[2-(trifluoromethyl)phenyl]quinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)-, 5-24-03-00133 (Beilstein Handbook Reference), BAS 05494697, 2-Methyl-3-(o-trifluoromethylphenyl)-4(3H)-quinazolinone, 2-Methyl-3-(2'-trifluoromethylphenyl)chinazolon-(4)
| Molecular Formula | C16H11F3N2O |
|---|---|
| Molecular Weight | 304.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 304.08234 |
| Heavy Atoms | 22 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 340-49-8 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C(F)(F)F |
| InChIKey | GODYPCWCGPASKK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)- (CAS 340-49-8), with molecular formula C16H11F3N2O and molecular weight 304.08 g/mol. IUPAC: 2-methyl-3-[2-(trifluoromethyl)phenyl]quinazolin-4-one.
Chemical Property Profile of 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)-
Property Insights of 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)-
The XLogP value of 3.0 indicates that 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)- 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)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)-?
The CAS number of 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)- is 340-49-8.
What is the molecular formula of 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)-?
The molecular formula of 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)- is C16H11F3N2O.
What is the molecular weight of 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)-?
The molecular weight of 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)- is 304.08 g/mol.
Where can I buy 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)-?
You can request a quote for 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinone, 2-methyl-3-(o-trifluoromethylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.