1H-Imidazole, 4-methyl-5-((methylthio)methyl)-
TL;DR: 1H-Imidazole, 4-methyl-5-((methylthio)methyl)- (CAS 75899-43-3) is a chemical compound with molecular formula C6H10N2S and molecular weight 142.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-4-(methylsulfanylmethyl)-1H-imidazole
Also Known As: 1H-Imidazole, 4-methyl-5-((methylthio)methyl)-, methyl (5-methyl-1H-imidazol-4-yl)methyl sulfide, 5-methyl-4-(methylsulfanylmethyl)-1H-imidazole, (5-methylimidazol-4-yl)methylthiomethane, 1H-Imidazole, 4-methyl-5-[(methylthio)methyl]-
| Molecular Formula | C6H10N2S |
|---|---|
| Molecular Weight | 142.06 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 142.05647 |
| Heavy Atoms | 9 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 75899-43-3 |
|---|---|
| SMILES | CC1=C(N=CN1)CSC |
| InChIKey | CPJAESGOQJNYOZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Imidazole, 4-methyl-5-((methylthio)methyl)- (CAS 75899-43-3), with molecular formula C6H10N2S and molecular weight 142.06 g/mol. IUPAC: 5-methyl-4-(methylsulfanylmethyl)-1H-imidazole.
Chemical Property Profile of 1H-Imidazole, 4-methyl-5-((methylthio)methyl)-
Property Insights of 1H-Imidazole, 4-methyl-5-((methylthio)methyl)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazole, 4-methyl-5-((methylthio)methyl)-. With a topological polar surface area (TPSA) of 54.0 Ų, 1H-Imidazole, 4-methyl-5-((methylthio)methyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Imidazole, 4-methyl-5-((methylthio)methyl)- has 1 hydrogen bond donor(s) and 2 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 1H-Imidazole, 4-methyl-5-((methylthio)methyl)-?
The CAS number of 1H-Imidazole, 4-methyl-5-((methylthio)methyl)- is 75899-43-3.
What is the molecular formula of 1H-Imidazole, 4-methyl-5-((methylthio)methyl)-?
The molecular formula of 1H-Imidazole, 4-methyl-5-((methylthio)methyl)- is C6H10N2S.
What is the molecular weight of 1H-Imidazole, 4-methyl-5-((methylthio)methyl)-?
The molecular weight of 1H-Imidazole, 4-methyl-5-((methylthio)methyl)- is 142.06 g/mol.
Where can I buy 1H-Imidazole, 4-methyl-5-((methylthio)methyl)-?
You can request a quote for 1H-Imidazole, 4-methyl-5-((methylthio)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazole, 4-methyl-5-((methylthio)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole, 4-methyl-5-((methylthio)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.