1H-Pyrazole, 1-methyl-5-(methylthio)-
TL;DR: 1H-Pyrazole, 1-methyl-5-(methylthio)- (CAS 87110-36-9) 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-5-methylsulfanylpyrazole
Also Known As: 1-methyl-5-(methylthio)-1H-pyrazole, 1H-Pyrazole, 1-methyl-5-(methylthio)-, 1-methyl-5-methylsulfanylpyrazole, 1H-Pyrazole, 1-methyl-5-(methylthio), 1-methyl-5-(methylsulfanyl)-1H-pyrazole
| Molecular Formula | C5H8N2S |
|---|---|
| Molecular Weight | 128.04 g/mol |
| LogP | 1.1 |
| 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 | 87110-36-9 |
|---|---|
| SMILES | CN1C(=CC=N1)SC |
| InChIKey | SYDUYYBXJOIWRX-UHFFFAOYSA-N |
Product Overview
1H-Pyrazole, 1-methyl-5-(methylthio)- (CAS 87110-36-9), with molecular formula C5H8N2S and molecular weight 128.04 g/mol. IUPAC: 1-methyl-5-methylsulfanylpyrazole.
Chemical Property Profile of 1H-Pyrazole, 1-methyl-5-(methylthio)-
Property Insights of 1H-Pyrazole, 1-methyl-5-(methylthio)-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrazole, 1-methyl-5-(methylthio)-. With a topological polar surface area (TPSA) of 43.1 Ų, 1H-Pyrazole, 1-methyl-5-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrazole, 1-methyl-5-(methylthio)- 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 1H-Pyrazole, 1-methyl-5-(methylthio)-?
The CAS number of 1H-Pyrazole, 1-methyl-5-(methylthio)- is 87110-36-9.
What is the molecular formula of 1H-Pyrazole, 1-methyl-5-(methylthio)-?
The molecular formula of 1H-Pyrazole, 1-methyl-5-(methylthio)- is C5H8N2S.
What is the molecular weight of 1H-Pyrazole, 1-methyl-5-(methylthio)-?
The molecular weight of 1H-Pyrazole, 1-methyl-5-(methylthio)- is 128.04 g/mol.
Where can I buy 1H-Pyrazole, 1-methyl-5-(methylthio)-?
You can request a quote for 1H-Pyrazole, 1-methyl-5-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole, 1-methyl-5-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole, 1-methyl-5-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.