![N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide structure](/static/products/861/861139-22-2.png)
N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide
TL;DR: N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide (CAS 861139-22-2) is a chemical compound with molecular formula C22H21N3O2S and molecular weight 391.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethylphenyl)-2-[(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Also Known As: N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide, N-(2,5-dimethylphenyl)-2-[(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide, N-(2,5-dimethylphenyl)-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
| Molecular Formula | C22H21N3O2S |
|---|---|
| Molecular Weight | 391.14 g/mol |
| LogP | 5.28604 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.13544 |
| Heavy Atoms | 28 |
| Complexity | 1183.3065 |
Chemical Identifiers
| CAS Number | 861139-22-2 |
|---|---|
| SMILES | CCC1=NC2=C(C(=N1)SCC(=O)NC3=C(C=CC(=C3)C)C)OC4=CC=CC=C42 |
Product Overview
N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide (CAS 861139-22-2), with molecular formula C22H21N3O2S and molecular weight 391.14 g/mol. IUPAC: N-(2,5-dimethylphenyl)-2-[(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide.
Chemical Property Profile of N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide
Property Insights of N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide
The XLogP value of 5.28604 indicates that N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)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 N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide. Following Lipinski's Rule of Five, N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)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 N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide?
The CAS number of N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide is 861139-22-2.
What is the molecular formula of N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide?
The molecular formula of N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide is C22H21N3O2S.
What is the molecular weight of N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide?
The molecular weight of N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide is 391.14 g/mol.
Where can I buy N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide?
You can request a quote for N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,5-dimethylphenyl)-2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.