5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid
TL;DR: 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid (CAS 54814-48-1) is a chemical compound with molecular formula C14H9NO3 and molecular weight 239.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-oxo-5H-phenanthridine-3-carboxylic acid
Also Known As: 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid, 6-oxo-5H-phenanthridine-3-carboxylic acid, Acido 6-fenantridon-3-carbossilico, 6-oxo-5,6-dihydrophenanthridine-3-carboxylic acid, Acido 6-fenantridon-3-carbossilico [Italian]
| Molecular Formula | C14H9NO3 |
|---|---|
| Molecular Weight | 239.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.05824 |
| Heavy Atoms | 18 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 54814-48-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(C=C(C=C3)C(=O)O)NC2=O |
| InChIKey | QCZYYHNRVZRTGW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid (CAS 54814-48-1), with molecular formula C14H9NO3 and molecular weight 239.06 g/mol. IUPAC: 6-oxo-5H-phenanthridine-3-carboxylic acid.
Chemical Property Profile of 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid
Property Insights of 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid. Following Lipinski's Rule of Five, 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid has 2 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 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid?
The CAS number of 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid is 54814-48-1.
What is the molecular formula of 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid?
The molecular formula of 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid is C14H9NO3.
What is the molecular weight of 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid?
The molecular weight of 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid is 239.06 g/mol.
Where can I buy 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid?
You can request a quote for 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.