8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate
TL;DR: 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate (CAS 724741-09-7) is a chemical compound with molecular formula C25H29NO6 and molecular weight 439.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate
Also Known As: 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate, propyl 4-({8-[(diethylamino)methyl]-7-hydroxy-2-methyl-4-oxo-4H-chromen-3-yl}oxy)benzoate, 8-(diethylammoniomethyl)-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate, 8-[(diethylammonio)methyl]-2-methyl-4-oxo-3-[4-(propoxycarbonyl)phenoxy]-4H-chromen-7-olate
| Molecular Formula | C25H29NO6 |
|---|---|
| Molecular Weight | 439.20 g/mol |
| LogP | 2.95882 |
| Topological Polar Surface Area | 93.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 439.1995 |
| Heavy Atoms | 32 |
| Complexity | 1145.7913 |
Chemical Identifiers
| CAS Number | 724741-09-7 |
|---|---|
| SMILES | CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3C[NH+](CC)CC)[O-])C |
Product Overview
8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate (CAS 724741-09-7), with molecular formula C25H29NO6 and molecular weight 439.20 g/mol. IUPAC: 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate.
Chemical Property Profile of 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate
Property Insights of 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate
The XLogP value of 2.95882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate. The TPSA of 93.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate. Following Lipinski's Rule of Five, 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate has 1 hydrogen bond donor(s) and 6 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 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate?
The CAS number of 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate is 724741-09-7.
What is the molecular formula of 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate?
The molecular formula of 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate is C25H29NO6.
What is the molecular weight of 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate?
The molecular weight of 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate is 439.20 g/mol.
Where can I buy 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate?
You can request a quote for 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate?
Yes, KEHONG BIO provides custom synthesis services for 8-[(diethylazaniumyl)methyl]-2-methyl-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.