![methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate structure](/static/products/799/79938-44-6.png)
methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate
TL;DR: methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate (CAS 79938-44-6) is a chemical compound with molecular formula C11H12N2O3S and molecular weight 252.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate
Also Known As: methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate, methyl 2-(5-methoxybenzimidazol-2-ylthio)acetate, methyl 2-((5-methoxy-2-benzimidazolyl)thio)acetate, methyl [(5-methoxy-1H-benzimidazol-2-yl)thio]acetate, methyl 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate
| Molecular Formula | C11H12N2O3S |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 1.8366 |
| Topological Polar Surface Area | 64.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.05687 |
| Heavy Atoms | 17 |
| Complexity | 538.4961 |
Chemical Identifiers
| CAS Number | 79938-44-6 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)N=C(N2)SCC(=O)OC |
Product Overview
methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate (CAS 79938-44-6), with molecular formula C11H12N2O3S and molecular weight 252.06 g/mol. IUPAC: methyl 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate.
Chemical Property Profile of methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate
Property Insights of methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate
The XLogP value of 1.8366 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate. The TPSA of 64.21 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate. Following Lipinski's Rule of Five, methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate 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 methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate?
The CAS number of methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate is 79938-44-6.
What is the molecular formula of methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate?
The molecular formula of methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate is C11H12N2O3S.
What is the molecular weight of methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate?
The molecular weight of methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate is 252.06 g/mol.
Where can I buy methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate?
You can request a quote for methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl [(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.