4-Quinazolinyl 2,4,6-trimethylbenzoate
TL;DR: 4-Quinazolinyl 2,4,6-trimethylbenzoate (CAS 496875-32-2) is a chemical compound with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
quinazolin-4-yl 2,4,6-trimethylbenzoate
Also Known As: 4-quinazolinyl 2,4,6-trimethylbenzoate, quinazolin-4-yl 2,4,6-trimethylbenzoate, AN-970/40920658
| Molecular Formula | C18H16N2O2 |
|---|---|
| Molecular Weight | 292.12 g/mol |
| LogP | 3.77426 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.1212 |
| Heavy Atoms | 22 |
| Complexity | 843.5902 |
Chemical Identifiers
| CAS Number | 496875-32-2 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)C(=O)OC2=NC=NC3=CC=CC=C32)C |
Product Overview
4-Quinazolinyl 2,4,6-trimethylbenzoate (CAS 496875-32-2), with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol. IUPAC: quinazolin-4-yl 2,4,6-trimethylbenzoate.
Chemical Property Profile of 4-Quinazolinyl 2,4,6-trimethylbenzoate
Property Insights of 4-Quinazolinyl 2,4,6-trimethylbenzoate
The XLogP value of 3.77426 indicates that 4-Quinazolinyl 2,4,6-trimethylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.08 Ų, 4-Quinazolinyl 2,4,6-trimethylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Quinazolinyl 2,4,6-trimethylbenzoate 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-Quinazolinyl 2,4,6-trimethylbenzoate?
The CAS number of 4-Quinazolinyl 2,4,6-trimethylbenzoate is 496875-32-2.
What is the molecular formula of 4-Quinazolinyl 2,4,6-trimethylbenzoate?
The molecular formula of 4-Quinazolinyl 2,4,6-trimethylbenzoate is C18H16N2O2.
What is the molecular weight of 4-Quinazolinyl 2,4,6-trimethylbenzoate?
The molecular weight of 4-Quinazolinyl 2,4,6-trimethylbenzoate is 292.12 g/mol.
Where can I buy 4-Quinazolinyl 2,4,6-trimethylbenzoate?
You can request a quote for 4-Quinazolinyl 2,4,6-trimethylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Quinazolinyl 2,4,6-trimethylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Quinazolinyl 2,4,6-trimethylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.