2-Phenazinecarbonitrile
TL;DR: 2-Phenazinecarbonitrile (CAS 6479-93-2) is a chemical compound with molecular formula C13H7N3 and molecular weight 205.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenazine-2-carbonitrile
Also Known As: phenazine-2-carbonitrile, 2-Phenazinecarbonitrile, 2-Cyanophenazine, 2-Cyano-phenazin
| Molecular Formula | C13H7N3 |
|---|---|
| Molecular Weight | 205.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 49.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 205.064 |
| Heavy Atoms | 16 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 6479-93-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3C=CC(=CC3=N2)C#N |
| InChIKey | IWDIQIINIKFOEB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Phenazinecarbonitrile (CAS 6479-93-2), with molecular formula C13H7N3 and molecular weight 205.06 g/mol. IUPAC: phenazine-2-carbonitrile.
Chemical Property Profile of 2-Phenazinecarbonitrile
Property Insights of 2-Phenazinecarbonitrile
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenazinecarbonitrile. With a topological polar surface area (TPSA) of 49.6 Ų, 2-Phenazinecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenazinecarbonitrile 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 2-Phenazinecarbonitrile?
The CAS number of 2-Phenazinecarbonitrile is 6479-93-2.
What is the molecular formula of 2-Phenazinecarbonitrile?
The molecular formula of 2-Phenazinecarbonitrile is C13H7N3.
What is the molecular weight of 2-Phenazinecarbonitrile?
The molecular weight of 2-Phenazinecarbonitrile is 205.06 g/mol.
Where can I buy 2-Phenazinecarbonitrile?
You can request a quote for 2-Phenazinecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenazinecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenazinecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.