3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one
TL;DR: 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one (CAS 848929-54-4) is a chemical compound with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxy-2-methylsulfanylquinazolin-4-one
Also Known As: 3-ethoxy-2-methylsulfanylquinazolin-4-one, 3-ethoxy-2-(methylthio)quinazolin-4(3H)-one, 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one
| Molecular Formula | C11H12N2O2S |
|---|---|
| Molecular Weight | 236.06 g/mol |
| LogP | 1.5669 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.06195 |
| Heavy Atoms | 16 |
| Complexity | 565.4034 |
Chemical Identifiers
| CAS Number | 848929-54-4 |
|---|---|
| SMILES | CCON1C(=O)C2=CC=CC=C2N=C1SC |
Product Overview
3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one (CAS 848929-54-4), with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol. IUPAC: 3-ethoxy-2-methylsulfanylquinazolin-4-one.
Chemical Property Profile of 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one
Property Insights of 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one
The XLogP value of 1.5669 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one. With a topological polar surface area (TPSA) of 44.12 Ų, 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one 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 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one?
The CAS number of 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one is 848929-54-4.
What is the molecular formula of 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one?
The molecular formula of 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one is C11H12N2O2S.
What is the molecular weight of 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one?
The molecular weight of 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one is 236.06 g/mol.
Where can I buy 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one?
You can request a quote for 3-ethoxy-2-(methylsulfanyl)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-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-ethoxy-2-(methylsulfanyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.