![1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone structure](/static/products/846/846597-36-2.png)
1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone
TL;DR: 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone (CAS 846597-36-2) is a chemical compound with molecular formula C21H14N2O3S and molecular weight 374.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone
Also Known As: 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone, 1-(1-benzofuran-2-yl)-2-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone, 1-(benzofuran-2-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone
| Molecular Formula | C21H14N2O3S |
|---|---|
| Molecular Weight | 374.07 g/mol |
| LogP | 5.40562 |
| Topological Polar Surface Area | 69.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.0725 |
| Heavy Atoms | 27 |
| Complexity | 1286.2775 |
Chemical Identifiers
| CAS Number | 846597-36-2 |
|---|---|
| SMILES | CC1=NC2=C(C(=N1)SCC(=O)C3=CC4=CC=CC=C4O3)OC5=CC=CC=C52 |
Product Overview
1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone (CAS 846597-36-2), with molecular formula C21H14N2O3S and molecular weight 374.07 g/mol. IUPAC: 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone.
Chemical Property Profile of 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone
Property Insights of 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone
The XLogP value of 5.40562 indicates that 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone. Following Lipinski's Rule of Five, 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone?
The CAS number of 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone is 846597-36-2.
What is the molecular formula of 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone?
The molecular formula of 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone is C21H14N2O3S.
What is the molecular weight of 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone?
The molecular weight of 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone is 374.07 g/mol.
Where can I buy 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone?
You can request a quote for 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-benzofuran-2-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.