1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole
TL;DR: 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole (CAS 794559-37-8) is a chemical compound with molecular formula C10H16N2OS and molecular weight 212.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2-(oxan-2-ylmethylsulfanyl)imidazole
Also Known As: 1-methyl-2-(oxan-2-ylmethylsulfanyl)imidazole, 1-Methyl-2-(((tetrahydro-2H-pyran-2-yl)methyl)thio)-1H-imidazole, 1H-Imidazole, 1-methyl-2-[[(tetrahydro-2H-pyran-2-yl)methyl]thio]- (9CI)
| Molecular Formula | C10H16N2OS |
|---|---|
| Molecular Weight | 212.10 g/mol |
| LogP | 2.0813 |
| Topological Polar Surface Area | 27.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.09833 |
| Heavy Atoms | 14 |
| Complexity | 281.4043 |
Chemical Identifiers
| CAS Number | 794559-37-8 |
|---|---|
| SMILES | CN1C=CN=C1SCC2CCCCO2 |
Product Overview
1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole (CAS 794559-37-8), with molecular formula C10H16N2OS and molecular weight 212.10 g/mol. IUPAC: 1-methyl-2-(oxan-2-ylmethylsulfanyl)imidazole.
Chemical Property Profile of 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole
Property Insights of 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole
The XLogP value of 2.0813 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole. With a topological polar surface area (TPSA) of 27.05 Ų, 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole has 0 hydrogen bond donor(s) and 3 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 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole?
The CAS number of 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole is 794559-37-8.
What is the molecular formula of 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole?
The molecular formula of 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole is C10H16N2OS.
What is the molecular weight of 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole?
The molecular weight of 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole is 212.10 g/mol.
Where can I buy 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole?
You can request a quote for 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2-(oxan-2-ylmethylsulfanyl)imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.