Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate
TL;DR: Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate (CAS 6147-80-4) is a chemical compound with molecular formula C20H18N2O2S and molecular weight 350.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate
Also Known As: ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate, Ethyl 2-((4,6-diphenylpyrimidin-2-yl)thio)acetate, BIM-0015560.P001, ethyl [(4,6-diphenylpyrimidin-2-yl)sulfanyl]acetate, ETHYL 2-[(4,6-DIPHENYLPYRIMIDIN-2-YL)SULFANYL]ACETATE
| Molecular Formula | C20H18N2O2S |
|---|---|
| Molecular Weight | 350.11 g/mol |
| LogP | 4.4658 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 350.1089 |
| Heavy Atoms | 25 |
| Complexity | 781.0797 |
Chemical Identifiers
| CAS Number | 6147-80-4 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate (CAS 6147-80-4), with molecular formula C20H18N2O2S and molecular weight 350.11 g/mol. IUPAC: ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate.
Chemical Property Profile of Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate
Property Insights of Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate
The XLogP value of 4.4658 indicates that Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate 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-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate 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-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate?
The CAS number of Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate is 6147-80-4.
What is the molecular formula of Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate?
The molecular formula of Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate is C20H18N2O2S.
What is the molecular weight of Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate?
The molecular weight of Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate is 350.11 g/mol.
Where can I buy Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate?
You can request a quote for Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.