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4H-Benzo[a]quinolizin-4-one
TL;DR: 4H-Benzo[a]quinolizin-4-one (CAS 61259-58-3) is a chemical compound with molecular formula C13H9NO and molecular weight 195.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzo[a]quinolizin-4-one
Also Known As: benzo[a]quinolizin-4-one, 4H-Benzo[a]quinolizin-4-one, 4H-Pyrido[2,1-a]isoquinolin-4-one, GVSAARYACCSJNI-UHFFFAOYSA-, InChI=1/C13H9NO/c15-13-7-3-6-12-11-5-2-1-4-10(11)8-9-14(12)13/h1-9H
| Molecular Formula | C13H9NO |
|---|---|
| Molecular Weight | 195.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 195.06842 |
| Heavy Atoms | 15 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 61259-58-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CN3C2=CC=CC3=O |
| InChIKey | GVSAARYACCSJNI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4H-Benzo[a]quinolizin-4-one (CAS 61259-58-3), with molecular formula C13H9NO and molecular weight 195.07 g/mol. IUPAC: benzo[a]quinolizin-4-one.
Chemical Property Profile of 4H-Benzo[a]quinolizin-4-one
Property Insights of 4H-Benzo[a]quinolizin-4-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-Benzo[a]quinolizin-4-one. With a topological polar surface area (TPSA) of 20.3 Ų, 4H-Benzo[a]quinolizin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-Benzo[a]quinolizin-4-one has 0 hydrogen bond donor(s) and 1 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 4H-Benzo[a]quinolizin-4-one?
The CAS number of 4H-Benzo[a]quinolizin-4-one is 61259-58-3.
What is the molecular formula of 4H-Benzo[a]quinolizin-4-one?
The molecular formula of 4H-Benzo[a]quinolizin-4-one is C13H9NO.
What is the molecular weight of 4H-Benzo[a]quinolizin-4-one?
The molecular weight of 4H-Benzo[a]quinolizin-4-one is 195.07 g/mol.
Where can I buy 4H-Benzo[a]quinolizin-4-one?
You can request a quote for 4H-Benzo[a]quinolizin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Benzo[a]quinolizin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 4H-Benzo[a]quinolizin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.