![Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate structure](/static/products/577/577696-52-7.png)
Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
TL;DR: Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate (CAS 577696-52-7) is a chemical compound with molecular formula C12H12N2O4S and molecular weight 280.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(3-methoxy-4-oxoquinazolin-2-yl)sulfanylacetate
Also Known As: methyl 2-(3-methoxy-4-oxoquinazolin-2-yl)sulfanylacetate, methyl 2-((3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetate, methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
| Molecular Formula | C12H12N2O4S |
|---|---|
| Molecular Weight | 280.05 g/mol |
| LogP | 0.72 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.0518 |
| Heavy Atoms | 19 |
| Complexity | 668.31726 |
Chemical Identifiers
| CAS Number | 577696-52-7 |
|---|---|
| SMILES | COC(=O)CSC1=NC2=CC=CC=C2C(=O)N1OC |
Product Overview
Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate (CAS 577696-52-7), with molecular formula C12H12N2O4S and molecular weight 280.05 g/mol. IUPAC: methyl 2-(3-methoxy-4-oxoquinazolin-2-yl)sulfanylacetate.
Chemical Property Profile of Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
Property Insights of Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
The XLogP value of 0.72 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate. Following Lipinski's Rule of Five, Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate has 0 hydrogen bond donor(s) and 6 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 Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate?
The CAS number of Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate is 577696-52-7.
What is the molecular formula of Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate?
The molecular formula of Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate is C12H12N2O4S.
What is the molecular weight of Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate?
The molecular weight of Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate is 280.05 g/mol.
Where can I buy Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate?
You can request a quote for Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [(3-methoxy-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.