Methimazole methyl sulfide
TL;DR: Methimazole methyl sulfide (CAS 14486-52-3) is a chemical compound with molecular formula C5H8N2S and molecular weight 128.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2-methylsulfanylimidazole
Also Known As: 1-Methyl-2-(methylthio)imidazole, thiamazole, 1-METHYL-2-(METHYLTHIO)-1H-IMIDAZOLE, 1-methyl-2-(methylsulfanyl)-1H-imidazole, Thiamazole impurity C
| Molecular Formula | C5H8N2S |
|---|---|
| Molecular Weight | 128.04 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 128.04082 |
| Heavy Atoms | 8 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 14486-52-3 |
|---|---|
| SMILES | CN1C=CN=C1SC |
| InChIKey | LKIVEIAXFZBGMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methimazole methyl sulfide (CAS 14486-52-3), with molecular formula C5H8N2S and molecular weight 128.04 g/mol. IUPAC: 1-methyl-2-methylsulfanylimidazole.
Chemical Property Profile of Methimazole methyl sulfide
Property Insights of Methimazole methyl sulfide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methimazole methyl sulfide. With a topological polar surface area (TPSA) of 43.1 Ų, Methimazole methyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methimazole methyl sulfide has 0 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 Methimazole methyl sulfide?
The CAS number of Methimazole methyl sulfide is 14486-52-3.
What is the molecular formula of Methimazole methyl sulfide?
The molecular formula of Methimazole methyl sulfide is C5H8N2S.
What is the molecular weight of Methimazole methyl sulfide?
The molecular weight of Methimazole methyl sulfide is 128.04 g/mol.
Where can I buy Methimazole methyl sulfide?
You can request a quote for Methimazole methyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methimazole methyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for Methimazole methyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.