![[5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol structure](/static/products/117/117121-05-8.png)
[5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol
TL;DR: [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol (CAS 117121-05-8) is a chemical compound with molecular formula C7H12N2O2S and molecular weight 188.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol
Also Known As: NCI60_007161, 1-methyl-2-(methylthio)-4,5-bis(hydroxymethyl)imidazole, 1-Methyl-2-(methylthio)-1H-imidazole-4,5-dimethanol, [1-methyl-2-(methylsulfanyl)-1H-imidazole-4,5-diyl]dimethanol, [5-(hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol
| Molecular Formula | C7H12N2O2S |
|---|---|
| Molecular Weight | 188.06 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.06195 |
| Heavy Atoms | 12 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 117121-05-8 |
|---|---|
| SMILES | CN1C(=C(N=C1SC)CO)CO |
| InChIKey | UOMQKJDFWKVMSV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol (CAS 117121-05-8), with molecular formula C7H12N2O2S and molecular weight 188.06 g/mol. IUPAC: [5-(hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol.
Chemical Property Profile of [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol
Property Insights of [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol
The XLogP value of -0.8 indicates that [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol. Following Lipinski's Rule of Five, [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol has 2 hydrogen bond donor(s) and 4 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 [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol?
The CAS number of [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol is 117121-05-8.
What is the molecular formula of [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol?
The molecular formula of [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol is C7H12N2O2S.
What is the molecular weight of [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol?
The molecular weight of [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol is 188.06 g/mol.
Where can I buy [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol?
You can request a quote for [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol?
Yes, KEHONG BIO provides custom synthesis services for [5-(Hydroxymethyl)-1-methyl-2-methylsulfanylimidazol-4-yl]methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.