![6-Oxobenzo[c]quinolizine-5-carbonitrile structure](/static/products/105/105098-91-7.png)
6-Oxobenzo[c]quinolizine-5-carbonitrile
TL;DR: 6-Oxobenzo[c]quinolizine-5-carbonitrile (CAS 105098-91-7) is a chemical compound with molecular formula C14H8N2O and molecular weight 220.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-oxobenzo[c]quinolizine-5-carbonitrile
Also Known As: 6-oxobenzo[c]quinolizine-5-carbonitrile, NCI60_032746, 6H-Benzo[c]quinolizine-5-carbonitrile, 6-oxo-, 6-oxo-6H-pyrido[1,2-a]quinoline-5-carbonitrile, BRD-K72478848-001-01-0
| Molecular Formula | C14H8N2O |
|---|---|
| Molecular Weight | 220.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 44.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 220.06366 |
| Heavy Atoms | 17 |
| Complexity | 504.0 |
Chemical Identifiers
| CAS Number | 105098-91-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=C3N2C=CC=C3)C#N |
| InChIKey | XTXMHKVVENPWKZ-UHFFFAOYSA-N |
Product Overview
6-Oxobenzo[c]quinolizine-5-carbonitrile (CAS 105098-91-7), with molecular formula C14H8N2O and molecular weight 220.06 g/mol. IUPAC: 6-oxobenzo[c]quinolizine-5-carbonitrile.
Chemical Property Profile of 6-Oxobenzo[c]quinolizine-5-carbonitrile
Property Insights of 6-Oxobenzo[c]quinolizine-5-carbonitrile
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Oxobenzo[c]quinolizine-5-carbonitrile. With a topological polar surface area (TPSA) of 44.1 Ų, 6-Oxobenzo[c]quinolizine-5-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Oxobenzo[c]quinolizine-5-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-Oxobenzo[c]quinolizine-5-carbonitrile?
The CAS number of 6-Oxobenzo[c]quinolizine-5-carbonitrile is 105098-91-7.
What is the molecular formula of 6-Oxobenzo[c]quinolizine-5-carbonitrile?
The molecular formula of 6-Oxobenzo[c]quinolizine-5-carbonitrile is C14H8N2O.
What is the molecular weight of 6-Oxobenzo[c]quinolizine-5-carbonitrile?
The molecular weight of 6-Oxobenzo[c]quinolizine-5-carbonitrile is 220.06 g/mol.
Where can I buy 6-Oxobenzo[c]quinolizine-5-carbonitrile?
You can request a quote for 6-Oxobenzo[c]quinolizine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Oxobenzo[c]quinolizine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Oxobenzo[c]quinolizine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.