![Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate structure](/static/products/859/859111-41-4.png)
Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate
TL;DR: Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate (CAS 859111-41-4) is a chemical compound with molecular formula C25H21NO5 and molecular weight 415.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methylamino]benzoate
Also Known As: ethyl 2-(((6-hydroxy-2-oxo-7-phenyl-2H-chromen-4-yl)methyl)amino)benzoate, ethyl 2-[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methylamino]benzoate, ethyl 2-{[(6-hydroxy-2-oxo-7-phenyl-2H-chromen-4-yl)methyl]amino}benzoate, ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate
| Molecular Formula | C25H21NO5 |
|---|---|
| Molecular Weight | 415.14 g/mol |
| LogP | 4.9544 |
| Topological Polar Surface Area | 88.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.14197 |
| Heavy Atoms | 31 |
| Complexity | 1294.5529 |
Chemical Identifiers
| CAS Number | 859111-41-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CC=C1NCC2=CC(=O)OC3=CC(=C(C=C23)O)C4=CC=CC=C4 |
Product Overview
Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate (CAS 859111-41-4), with molecular formula C25H21NO5 and molecular weight 415.14 g/mol. IUPAC: ethyl 2-[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methylamino]benzoate.
Chemical Property Profile of Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate
Property Insights of Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate
The XLogP value of 4.9544 indicates that Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate. Following Lipinski's Rule of Five, Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate has 2 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 Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate?
The CAS number of Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate is 859111-41-4.
What is the molecular formula of Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate?
The molecular formula of Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate is C25H21NO5.
What is the molecular weight of Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate?
The molecular weight of Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate is 415.14 g/mol.
Where can I buy Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate?
You can request a quote for Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-{[(6-hydroxy-2-oxo-7-phenylchromen-4-yl)methyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.