![2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate structure](/static/products/7716/77168-16-2.webp)
2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate
TL;DR: 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate (CAS 77168-16-2) is a chemical compound with molecular formula C11H14N2O3S2 and molecular weight 286.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methylbenzimidazol-2-yl)sulfanylethyl methanesulfonate
Also Known As: 2-(1-methylbenzimidazol-2-yl)sulfanylethyl methanesulfonate, 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate, 2-[(1-Methyl-1H-1,3-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate
| Molecular Formula | C11H14N2O3S2 |
|---|---|
| Molecular Weight | 286.04 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 94.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.0446 |
| Heavy Atoms | 18 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 77168-16-2 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1SCCOS(=O)(=O)C |
| InChIKey | JCQULAKXRYXHBR-UHFFFAOYSA-N |
Product Overview
2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate (CAS 77168-16-2), with molecular formula C11H14N2O3S2 and molecular weight 286.04 g/mol. IUPAC: 2-(1-methylbenzimidazol-2-yl)sulfanylethyl methanesulfonate.
Chemical Property Profile of 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate
Property Insights of 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate. The TPSA of 94.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate. Following Lipinski's Rule of Five, 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate has 0 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-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate?
The CAS number of 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate is 77168-16-2.
What is the molecular formula of 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate?
The molecular formula of 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate is C11H14N2O3S2.
What is the molecular weight of 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate?
The molecular weight of 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate is 286.04 g/mol.
Where can I buy 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate?
You can request a quote for 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1-Methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.