![2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate structure](/static/products/4979/497941-37-4.webp)
2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate
TL;DR: 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate (CAS 497941-37-4) is a chemical compound with molecular formula C20H19ClN2O2S and molecular weight 386.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,6,7-trimethylquinazolin-2-yl)sulfanylethyl 4-chlorobenzoate
Also Known As: 2-[(4,6,7-trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate, AJ-292/41686465, 2-(4,6,7-trimethylquinazolin-2-yl)sulfanylethyl 4-chlorobenzoate, 2-(4,6,7-trimethylquinazolin-2-ylthio)ethyl 4-chlorobenzoate, 2-((4,6,7-trimethylquinazolin-2-yl)thio)ethyl 4-chlorobenzoate
| Molecular Formula | C20H19ClN2O2S |
|---|---|
| Molecular Weight | 386.09 g/mol |
| LogP | 5.15756 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.08557 |
| Heavy Atoms | 26 |
| Complexity | 958.17755 |
Chemical Identifiers
| CAS Number | 497941-37-4 |
|---|---|
| SMILES | CC1=CC2=C(N=C(N=C2C=C1C)SCCOC(=O)C3=CC=C(C=C3)Cl)C |
Product Overview
2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate (CAS 497941-37-4), with molecular formula C20H19ClN2O2S and molecular weight 386.09 g/mol. IUPAC: 2-(4,6,7-trimethylquinazolin-2-yl)sulfanylethyl 4-chlorobenzoate.
Chemical Property Profile of 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate
Property Insights of 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate
The XLogP value of 5.15756 indicates that 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.08 Ų, 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate?
The CAS number of 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate is 497941-37-4.
What is the molecular formula of 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate?
The molecular formula of 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate is C20H19ClN2O2S.
What is the molecular weight of 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate?
The molecular weight of 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate is 386.09 g/mol.
Where can I buy 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate?
You can request a quote for 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4,6,7-Trimethylquinazolin-2-yl)sulfanyl]ethyl 4-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.