4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride
TL;DR: 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride (CAS 131028-58-5) is a chemical compound with molecular formula C12H14ClFN2S and molecular weight 272.05502 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-fluorophenyl)methylsulfanylmethyl]-5-methyl-1H-imidazole;hydrochloride
Also Known As: 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride, 1H-Imidazole, 4-((((4-fluorophenyl)methyl)thio)methyl)-5-methyl-, monohydrochlrodie, 4-fluorobenzyl (5-methyl-1H-imidazol-4-yl)methyl sulfide, 4-[(4-fluorophenyl)methylsulfanylmethyl]-5-methyl-1H-imidazole hydrochloride, 4-({[(4-Fluorophenyl)methyl]sulfanyl}methyl)-5-methyl-1H-imidazole--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C12H14ClFN2S |
| Molecular Weight | 272.05502 g/mol |
| XLogP | 3.71242 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.05502 Da |
| Heavy Atoms | 17 |
| Complexity | 207.0 |
| SMILES | CC1=C(N=CN1)CSCC2=CC=C(C=C2)F.Cl |
| InChIKey | HVMXHSVHLGBHMP-UHFFFAOYSA-N |
Chemical Property Profile of 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride
Property Insights of 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride
The XLogP value of 3.71242 indicates that 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride?
The CAS number of 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride is 131028-58-5.
What is the molecular formula of 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride?
The molecular formula of 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride is C12H14ClFN2S.
What is the molecular weight of 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride?
The molecular weight of 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride is 272.05502 g/mol.
Where can I buy 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride?
You can request a quote for 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride?
Yes, CoreyChem provides custom synthesis services for 4-((((4-Fluorophenyl)methyl)thio)methyl)-5-methyl-1H-imidazole monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.