![1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone structure](/static/products/848/848744-51-4.png)
1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone
TL;DR: 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone (CAS 848744-51-4) is a chemical compound with molecular formula C23H19N3O2S and molecular weight 401.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,2-dimethylindol-3-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone
Also Known As: 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone, 1-(1,2-Dimethyl-1H-indol-3-yl)-2-(2-methyl-benzo[4,5]furo[3,2-d]pyrimidin-4-ylsulfanyl)-ethanone, 1-(1,2-dimethyl-1H-indol-3-yl)-2-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone, 1-(1,2-dimethylindol-3-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone
| Molecular Formula | C23H19N3O2S |
|---|---|
| Molecular Weight | 401.12 g/mol |
| LogP | 5.45954 |
| Topological Polar Surface Area | 60.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.1198 |
| Heavy Atoms | 29 |
| Complexity | 1414.4885 |
Chemical Identifiers
| CAS Number | 848744-51-4 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1C)C(=O)CSC3=NC(=NC4=C3OC5=CC=CC=C54)C |
Product Overview
1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone (CAS 848744-51-4), with molecular formula C23H19N3O2S and molecular weight 401.12 g/mol. IUPAC: 1-(1,2-dimethylindol-3-yl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanone.
Chemical Property Profile of 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone
Property Insights of 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone
The XLogP value of 5.45954 indicates that 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone. Following Lipinski's Rule of Five, 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)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 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone?
The CAS number of 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone is 848744-51-4.
What is the molecular formula of 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone?
The molecular formula of 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone is C23H19N3O2S.
What is the molecular weight of 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone?
The molecular weight of 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone is 401.12 g/mol.
Where can I buy 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone?
You can request a quote for 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,2-dimethyl-1H-indol-3-yl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.