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Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate
TL;DR: Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate (CAS 303149-44-2) is a chemical compound with molecular formula C19H17ClN2O2S and molecular weight 372.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[(4-chlorophenyl)methyl]quinazolin-4-yl]sulfanylacetate
Also Known As: Bionet1_000470, 11F-408S, ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate, ethyl 2-[2-[(4-chlorophenyl)methyl]quinazolin-4-yl]sulfanylacetate, ethyl 2-({2-[(4-chlorophenyl)methyl]quinazolin-4-yl}sulfanyl)acetate
| Molecular Formula | C19H17ClN2O2S |
|---|---|
| Molecular Weight | 372.07 g/mol |
| LogP | 4.5292 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 372.06992 |
| Heavy Atoms | 25 |
| Complexity | 884.23145 |
Chemical Identifiers
| CAS Number | 303149-44-2 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC(=NC2=CC=CC=C21)CC3=CC=C(C=C3)Cl |
Product Overview
Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate (CAS 303149-44-2), with molecular formula C19H17ClN2O2S and molecular weight 372.07 g/mol. IUPAC: ethyl 2-[2-[(4-chlorophenyl)methyl]quinazolin-4-yl]sulfanylacetate.
Chemical Property Profile of Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate
Property Insights of Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate
The XLogP value of 4.5292 indicates that Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.08 Ų, Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate 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 Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate?
The CAS number of Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate is 303149-44-2.
What is the molecular formula of Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate?
The molecular formula of Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate is C19H17ClN2O2S.
What is the molecular weight of Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate?
The molecular weight of Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate is 372.07 g/mol.
Where can I buy Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate?
You can request a quote for Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-{[2-(4-chlorobenzyl)-4-quinazolinyl]sulfanyl}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.