3-(Methylsulfanyl)pyridazine
TL;DR: 3-(Methylsulfanyl)pyridazine (CAS 22049-21-4) is a chemical compound with molecular formula C5H6N2S and molecular weight 126.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylsulfanylpyridazine
Also Known As: 3-methylsulfanylpyridazine, 3-(methylsulfanyl)pyridazine, 3-methylthiopyridazine, 3-(Methylthio)pyridazine, 3-methylthio-pyridazine
| Molecular Formula | C5H6N2S |
|---|---|
| Molecular Weight | 126.03 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 126.02517 |
| Heavy Atoms | 8 |
| Complexity | 67.0 |
Chemical Identifiers
| CAS Number | 22049-21-4 |
|---|---|
| SMILES | CSC1=NN=CC=C1 |
| InChIKey | MXMJHNGIWGMNIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Methylsulfanyl)pyridazine (CAS 22049-21-4), with molecular formula C5H6N2S and molecular weight 126.03 g/mol. IUPAC: 3-methylsulfanylpyridazine.
Chemical Property Profile of 3-(Methylsulfanyl)pyridazine
Property Insights of 3-(Methylsulfanyl)pyridazine
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Methylsulfanyl)pyridazine. With a topological polar surface area (TPSA) of 51.1 Ų, 3-(Methylsulfanyl)pyridazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Methylsulfanyl)pyridazine has 0 hydrogen bond donor(s) and 3 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)pyridazine?
The CAS number of 3-(Methylsulfanyl)pyridazine is 22049-21-4.
What is the molecular formula of 3-(Methylsulfanyl)pyridazine?
The molecular formula of 3-(Methylsulfanyl)pyridazine is C5H6N2S.
What is the molecular weight of 3-(Methylsulfanyl)pyridazine?
The molecular weight of 3-(Methylsulfanyl)pyridazine is 126.03 g/mol.
Where can I buy 3-(Methylsulfanyl)pyridazine?
You can request a quote for 3-(Methylsulfanyl)pyridazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Methylsulfanyl)pyridazine?
Yes, KEHONG BIO provides custom synthesis services for 3-(Methylsulfanyl)pyridazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.