Pyrazine, 2-heptyl-3-methoxy
TL;DR: Pyrazine, 2-heptyl-3-methoxy (CAS 113685-79-3) is a chemical compound with molecular formula C12H20N2O and molecular weight 208.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-heptyl-3-methoxypyrazine
Also Known As: 2-heptyl-3-methoxypyrazine, Pyrazine, 2-heptyl-3-methoxy, Pyrazine, 2-heptyl-3-methoxy-
| Molecular Formula | C12H20N2O |
|---|---|
| Molecular Weight | 208.16 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 35.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 208.15756 |
| Heavy Atoms | 15 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 113685-79-3 |
|---|---|
| SMILES | CCCCCCCC1=NC=CN=C1OC |
| InChIKey | PPSICHXRNQPVJZ-UHFFFAOYSA-N |
Product Overview
Pyrazine, 2-heptyl-3-methoxy (CAS 113685-79-3), with molecular formula C12H20N2O and molecular weight 208.16 g/mol. IUPAC: 2-heptyl-3-methoxypyrazine.
Chemical Property Profile of Pyrazine, 2-heptyl-3-methoxy
Property Insights of Pyrazine, 2-heptyl-3-methoxy
The XLogP value of 4.3 indicates that Pyrazine, 2-heptyl-3-methoxy is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.0 Ų, Pyrazine, 2-heptyl-3-methoxy exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazine, 2-heptyl-3-methoxy 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-heptyl-3-methoxy?
The CAS number of Pyrazine, 2-heptyl-3-methoxy is 113685-79-3.
What is the molecular formula of Pyrazine, 2-heptyl-3-methoxy?
The molecular formula of Pyrazine, 2-heptyl-3-methoxy is C12H20N2O.
What is the molecular weight of Pyrazine, 2-heptyl-3-methoxy?
The molecular weight of Pyrazine, 2-heptyl-3-methoxy is 208.16 g/mol.
Where can I buy Pyrazine, 2-heptyl-3-methoxy?
You can request a quote for Pyrazine, 2-heptyl-3-methoxy directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazine, 2-heptyl-3-methoxy?
Yes, KEHONG BIO provides custom synthesis services for Pyrazine, 2-heptyl-3-methoxy and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.