6-Chloropyrazine-2-carbonitrile
TL;DR: 6-Chloropyrazine-2-carbonitrile (CAS 6863-74-7) is a chemical compound with molecular formula C5H2ClN3 and molecular weight 138.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloropyrazine-2-carbonitrile
Also Known As: 6-Chloropyrazine-2-carbonitrile, 2-Chloro-6-cyanopyrazine, 2-chloro-6-cyano-pyrazine, 6-Chloropyrazinecarbonitrile, Pyrazinecarbonitrile, 6-chloro-
| Molecular Formula | C5H2ClN3 |
|---|---|
| Molecular Weight | 138.99 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 49.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.99373 |
| Heavy Atoms | 9 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 6863-74-7 |
|---|---|
| SMILES | C1=C(N=C(C=N1)Cl)C#N |
| InChIKey | CZPOFSDHJNNWQL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chloropyrazine-2-carbonitrile (CAS 6863-74-7), with molecular formula C5H2ClN3 and molecular weight 138.99 g/mol. IUPAC: 6-chloropyrazine-2-carbonitrile.
Chemical Property Profile of 6-Chloropyrazine-2-carbonitrile
Property Insights of 6-Chloropyrazine-2-carbonitrile
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloropyrazine-2-carbonitrile. With a topological polar surface area (TPSA) of 49.6 Ų, 6-Chloropyrazine-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloropyrazine-2-carbonitrile 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 6-Chloropyrazine-2-carbonitrile?
The CAS number of 6-Chloropyrazine-2-carbonitrile is 6863-74-7.
What is the molecular formula of 6-Chloropyrazine-2-carbonitrile?
The molecular formula of 6-Chloropyrazine-2-carbonitrile is C5H2ClN3.
What is the molecular weight of 6-Chloropyrazine-2-carbonitrile?
The molecular weight of 6-Chloropyrazine-2-carbonitrile is 138.99 g/mol.
Where can I buy 6-Chloropyrazine-2-carbonitrile?
You can request a quote for 6-Chloropyrazine-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloropyrazine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloropyrazine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.