3-Phenoxypyrazine-2-carbonitrile
TL;DR: 3-Phenoxypyrazine-2-carbonitrile (CAS 87542-50-5) is a chemical compound with molecular formula C11H7N3O and molecular weight 197.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenoxypyrazine-2-carbonitrile
Also Known As: 3-phenoxypyrazine-2-carbonitrile, 2-Cyano-3-phenoxypyrazine, 3-phenoxy-2-pyrazinecarbonitrile, 2-Pyrazinecarbonitrile, 3-phenoxy-, 11K-397S
| Molecular Formula | C11H7N3O |
|---|---|
| Molecular Weight | 197.06 g/mol |
| LogP | 2.14058 |
| Topological Polar Surface Area | 58.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.05891 |
| Heavy Atoms | 15 |
| Complexity | 490.68625 |
Chemical Identifiers
| CAS Number | 87542-50-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=NC=CN=C2C#N |
Product Overview
3-Phenoxypyrazine-2-carbonitrile (CAS 87542-50-5), with molecular formula C11H7N3O and molecular weight 197.06 g/mol. IUPAC: 3-phenoxypyrazine-2-carbonitrile.
Chemical Property Profile of 3-Phenoxypyrazine-2-carbonitrile
Property Insights of 3-Phenoxypyrazine-2-carbonitrile
The XLogP value of 2.14058 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenoxypyrazine-2-carbonitrile. With a topological polar surface area (TPSA) of 58.8 Ų, 3-Phenoxypyrazine-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenoxypyrazine-2-carbonitrile has 0 hydrogen bond donor(s) and 4 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-Phenoxypyrazine-2-carbonitrile?
The CAS number of 3-Phenoxypyrazine-2-carbonitrile is 87542-50-5.
What is the molecular formula of 3-Phenoxypyrazine-2-carbonitrile?
The molecular formula of 3-Phenoxypyrazine-2-carbonitrile is C11H7N3O.
What is the molecular weight of 3-Phenoxypyrazine-2-carbonitrile?
The molecular weight of 3-Phenoxypyrazine-2-carbonitrile is 197.06 g/mol.
Where can I buy 3-Phenoxypyrazine-2-carbonitrile?
You can request a quote for 3-Phenoxypyrazine-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenoxypyrazine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenoxypyrazine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.