![Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate structure](/static/products/797/797769-31-4.png)
Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate
TL;DR: Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate (CAS 797769-31-4) is a chemical compound with molecular formula C12H18N2O2S and molecular weight 254.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanylacetate
Also Known As: ethyl 2-((5-ethyl-4,6-dimethylpyrimidin-2-yl)thio)acetate, ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate, ethyl 2-(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanylacetate
| Molecular Formula | C12H18N2O2S |
|---|---|
| Molecular Weight | 254.11 g/mol |
| LogP | 2.31104 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 254.1089 |
| Heavy Atoms | 17 |
| Complexity | 384.48724 |
Chemical Identifiers
| CAS Number | 797769-31-4 |
|---|---|
| SMILES | CCC1=C(N=C(N=C1C)SCC(=O)OCC)C |
Product Overview
Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate (CAS 797769-31-4), with molecular formula C12H18N2O2S and molecular weight 254.11 g/mol. IUPAC: ethyl 2-(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanylacetate.
Chemical Property Profile of Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate
Property Insights of Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate
The XLogP value of 2.31104 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate. With a topological polar surface area (TPSA) of 52.08 Ų, Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)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 [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate?
The CAS number of Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate is 797769-31-4.
What is the molecular formula of Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate?
The molecular formula of Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate is C12H18N2O2S.
What is the molecular weight of Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate?
The molecular weight of Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate is 254.11 g/mol.
Where can I buy Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate?
You can request a quote for Ethyl [(5-ethyl-4,6-dimethylpyrimidin-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 Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [(5-ethyl-4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.