![2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide structure](/static/products/861/861115-99-3.png)
2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide
TL;DR: 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide (CAS 861115-99-3) is a chemical compound with molecular formula C20H14F3N3O2S and molecular weight 417.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide
Also Known As: 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide, 2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide, 2-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide
| Molecular Formula | C20H14F3N3O2S |
|---|---|
| Molecular Weight | 417.08 g/mol |
| LogP | 5.43402 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 417.0759 |
| Heavy Atoms | 29 |
| Complexity | 1220.7684 |
Chemical Identifiers
| CAS Number | 861115-99-3 |
|---|---|
| SMILES | CC1=NC2=C(C(=N1)SCC(=O)NC3=CC=CC=C3C(F)(F)F)OC4=CC=CC=C42 |
Product Overview
2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide (CAS 861115-99-3), with molecular formula C20H14F3N3O2S and molecular weight 417.08 g/mol. IUPAC: 2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide
Property Insights of 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide
The XLogP value of 5.43402 indicates that 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide. Following Lipinski's Rule of Five, 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide has 1 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-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide?
The CAS number of 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide is 861115-99-3.
What is the molecular formula of 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide?
The molecular formula of 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide is C20H14F3N3O2S.
What is the molecular weight of 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide?
The molecular weight of 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide is 417.08 g/mol.
Where can I buy 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide?
You can request a quote for 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.