3-Chloro-2,5-diethylpyrazine
TL;DR: 3-Chloro-2,5-diethylpyrazine (CAS 67714-53-8) is a chemical compound with molecular formula C8H11ClN2 and molecular weight 170.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-2,5-diethylpyrazine
Also Known As: 3-chloro-2,5-diethylpyrazine, 3-chloro-2,5-diethyl-pyrazine, 2-chloro-3,6-diethylpyrazine, 3,6-diethyl-2-chloropyrazine, 2-chloro-3,6-diethyl Pyrazine
| Molecular Formula | C8H11ClN2 |
|---|---|
| Molecular Weight | 170.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.06108 |
| Heavy Atoms | 11 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 67714-53-8 |
|---|---|
| SMILES | CCC1=CN=C(C(=N1)Cl)CC |
| InChIKey | OHKRYVAKYCCYNX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Chloro-2,5-diethylpyrazine (CAS 67714-53-8), with molecular formula C8H11ClN2 and molecular weight 170.06 g/mol. IUPAC: 3-chloro-2,5-diethylpyrazine.
Chemical Property Profile of 3-Chloro-2,5-diethylpyrazine
Property Insights of 3-Chloro-2,5-diethylpyrazine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-2,5-diethylpyrazine. With a topological polar surface area (TPSA) of 25.8 Ų, 3-Chloro-2,5-diethylpyrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-2,5-diethylpyrazine 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 3-Chloro-2,5-diethylpyrazine?
The CAS number of 3-Chloro-2,5-diethylpyrazine is 67714-53-8.
What is the molecular formula of 3-Chloro-2,5-diethylpyrazine?
The molecular formula of 3-Chloro-2,5-diethylpyrazine is C8H11ClN2.
What is the molecular weight of 3-Chloro-2,5-diethylpyrazine?
The molecular weight of 3-Chloro-2,5-diethylpyrazine is 170.06 g/mol.
Where can I buy 3-Chloro-2,5-diethylpyrazine?
You can request a quote for 3-Chloro-2,5-diethylpyrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-2,5-diethylpyrazine?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-2,5-diethylpyrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.