3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one
TL;DR: 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one (CAS 36244-10-7) 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.
3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4-one
Also Known As: 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one, 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4-one, 3-(4-methylphenyl)-2-(trifluoromethyl)-4(3H)-quinazolinone, 3-(4-methylphenyl)-2-(trifluoromethyl)-3-hydroquinazolin-4-one
| Molecular Formula | C16H11F3N2O |
|---|---|
| Molecular Weight | 304.08 g/mol |
| LogP | 3.6 |
| 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 | 467.0 |
Chemical Identifiers
| CAS Number | 36244-10-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(F)(F)F |
| InChIKey | CPHIPVWDLPJGNO-UHFFFAOYSA-N |
Product Overview
3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one (CAS 36244-10-7), with molecular formula C16H11F3N2O and molecular weight 304.08 g/mol. IUPAC: 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4-one.
Chemical Property Profile of 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one
Property Insights of 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one
The XLogP value of 3.6 indicates that 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one 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 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one?
The CAS number of 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one is 36244-10-7.
What is the molecular formula of 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one?
The molecular formula of 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one is C16H11F3N2O.
What is the molecular weight of 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one?
The molecular weight of 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one is 304.08 g/mol.
Where can I buy 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one?
You can request a quote for 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-methylphenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.