![2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone structure](/static/products/849/849005-72-7.png)
2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone
TL;DR: 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone (CAS 849005-72-7) is a chemical compound with molecular formula C21H18N2O2S and molecular weight 362.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-methylphenyl)ethanone
Also Known As: 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone, 2-[(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-methylphenyl)ethanone, 2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-methylphenyl)ethanone
| Molecular Formula | C21H18N2O2S |
|---|---|
| Molecular Weight | 362.11 g/mol |
| LogP | 5.22182 |
| Topological Polar Surface Area | 55.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.1089 |
| Heavy Atoms | 26 |
| Complexity | 1100.3586 |
Chemical Identifiers
| CAS Number | 849005-72-7 |
|---|---|
| SMILES | CCC1=NC2=C(C(=N1)SCC(=O)C3=CC=C(C=C3)C)OC4=CC=CC=C42 |
Product Overview
2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone (CAS 849005-72-7), with molecular formula C21H18N2O2S and molecular weight 362.11 g/mol. IUPAC: 2-[(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-methylphenyl)ethanone.
Chemical Property Profile of 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone
Property Insights of 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone
The XLogP value of 5.22182 indicates that 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.99 Ų, 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone has 0 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-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone?
The CAS number of 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone is 849005-72-7.
What is the molecular formula of 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone?
The molecular formula of 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone is C21H18N2O2S.
What is the molecular weight of 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone?
The molecular weight of 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone is 362.11 g/mol.
Where can I buy 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone?
You can request a quote for 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.