Pyrazine, 2-(methylthio)-3-propyl-
TL;DR: Pyrazine, 2-(methylthio)-3-propyl- (CAS 68560-83-8) is a chemical compound with molecular formula C8H12N2S and molecular weight 168.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-3-propylpyrazine
Also Known As: Pyrazine, 2-(methylthio)-3-propyl-, 2-methylsulfanyl-3-propylpyrazine, Pyrazine, 2-methylthio-3-propyl, 2-(METHYLSULFANYL)-3-PROPYLPYRAZINE, (1Z)-[4-(Benzyloxy)-3-methoxyphenyl]ethanal oxime
| Molecular Formula | C8H12N2S |
|---|---|
| Molecular Weight | 168.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.07211 |
| Heavy Atoms | 11 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 68560-83-8 |
|---|---|
| SMILES | CCCC1=NC=CN=C1SC |
| InChIKey | BEHCKYZOZCUCEQ-UHFFFAOYSA-N |
Product Overview
Pyrazine, 2-(methylthio)-3-propyl- (CAS 68560-83-8), with molecular formula C8H12N2S and molecular weight 168.07 g/mol. IUPAC: 2-methylsulfanyl-3-propylpyrazine.
Chemical Property Profile of Pyrazine, 2-(methylthio)-3-propyl-
Property Insights of Pyrazine, 2-(methylthio)-3-propyl-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazine, 2-(methylthio)-3-propyl-. With a topological polar surface area (TPSA) of 51.1 Ų, Pyrazine, 2-(methylthio)-3-propyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazine, 2-(methylthio)-3-propyl- 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 Pyrazine, 2-(methylthio)-3-propyl-?
The CAS number of Pyrazine, 2-(methylthio)-3-propyl- is 68560-83-8.
What is the molecular formula of Pyrazine, 2-(methylthio)-3-propyl-?
The molecular formula of Pyrazine, 2-(methylthio)-3-propyl- is C8H12N2S.
What is the molecular weight of Pyrazine, 2-(methylthio)-3-propyl-?
The molecular weight of Pyrazine, 2-(methylthio)-3-propyl- is 168.07 g/mol.
Where can I buy Pyrazine, 2-(methylthio)-3-propyl-?
You can request a quote for Pyrazine, 2-(methylthio)-3-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazine, 2-(methylthio)-3-propyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyrazine, 2-(methylthio)-3-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.