2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone
TL;DR: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone (CAS 313255-93-5) is a chemical compound with molecular formula C17H16N2O3S and molecular weight 328.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone
Also Known As: IFLab1_000163, IDI1_008382, 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone, 2-(1H-benzimidazol-2-ylthio)-1-(2,4-dimethoxyphenyl)ethanone, 2-benzimidazol-2-ylthio-1-(2,4-dimethoxyphenyl)ethan-1-one
| Molecular Formula | C17H16N2O3S |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 89.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.08817 |
| Heavy Atoms | 23 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 313255-93-5 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N2)OC |
| InChIKey | OMZMLVQPMNDASN-UHFFFAOYSA-N |
Product Overview
2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone (CAS 313255-93-5), with molecular formula C17H16N2O3S and molecular weight 328.09 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone.
Chemical Property Profile of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone
Property Insights of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone
The XLogP value of 3.7 indicates that 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone. Following Lipinski's Rule of Five, 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone?
The CAS number of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone is 313255-93-5.
What is the molecular formula of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone?
The molecular formula of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone is C17H16N2O3S.
What is the molecular weight of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone?
The molecular weight of 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone is 328.09 g/mol.
Where can I buy 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone?
You can request a quote for 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,4-dimethoxyphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.