![3-[(Methylsulfanyl)methyl]-1H-pyrazole structure](/static/products/270/270920-35-9.png)
3-[(Methylsulfanyl)methyl]-1H-pyrazole
TL;DR: 3-[(Methylsulfanyl)methyl]-1H-pyrazole (CAS 270920-35-9) 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.
5-(methylsulfanylmethyl)-1H-pyrazole
Also Known As: 3-[(Methylsulfanyl)methyl]-1H-pyrazole, 3-(methylthiomethyl)pyrazole, 5-(methylsulfanylmethyl)-1H-pyrazole, 3-(methylsulfanylmethyl)-2H-pyrazole
| Molecular Formula | C5H8N2S |
|---|---|
| Molecular Weight | 128.04 g/mol |
| LogP | 1.2727 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 128.04082 |
| Heavy Atoms | 8 |
| Complexity | 136.14871 |
Chemical Identifiers
| CAS Number | 270920-35-9 |
|---|---|
| SMILES | CSCC1=CC=NN1 |
Product Overview
3-[(Methylsulfanyl)methyl]-1H-pyrazole (CAS 270920-35-9), with molecular formula C5H8N2S and molecular weight 128.04 g/mol. IUPAC: 5-(methylsulfanylmethyl)-1H-pyrazole.
Chemical Property Profile of 3-[(Methylsulfanyl)methyl]-1H-pyrazole
Property Insights of 3-[(Methylsulfanyl)methyl]-1H-pyrazole
The XLogP value of 1.2727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(Methylsulfanyl)methyl]-1H-pyrazole. With a topological polar surface area (TPSA) of 28.68 Ų, 3-[(Methylsulfanyl)methyl]-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(Methylsulfanyl)methyl]-1H-pyrazole 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 3-[(Methylsulfanyl)methyl]-1H-pyrazole?
The CAS number of 3-[(Methylsulfanyl)methyl]-1H-pyrazole is 270920-35-9.
What is the molecular formula of 3-[(Methylsulfanyl)methyl]-1H-pyrazole?
The molecular formula of 3-[(Methylsulfanyl)methyl]-1H-pyrazole is C5H8N2S.
What is the molecular weight of 3-[(Methylsulfanyl)methyl]-1H-pyrazole?
The molecular weight of 3-[(Methylsulfanyl)methyl]-1H-pyrazole is 128.04 g/mol.
Where can I buy 3-[(Methylsulfanyl)methyl]-1H-pyrazole?
You can request a quote for 3-[(Methylsulfanyl)methyl]-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Methylsulfanyl)methyl]-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Methylsulfanyl)methyl]-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.