2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate
TL;DR: 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate (CAS 22812-33-5) is a chemical compound with molecular formula C25H18O5 and molecular weight 398.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methoxyphenyl)-4-oxochromen-3-yl] (E)-3-phenylprop-2-enoate
Also Known As: 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate, AA-768/31451010, [2-(4-methoxyphenyl)-4-oxochromen-3-yl] (E)-3-phenylprop-2-enoate, 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl (2E)-3-phenylprop-2-enoate, 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl(2E)-3-phenylprop-2-enoate
| Molecular Formula | C25H18O5 |
|---|---|
| Molecular Weight | 398.12 g/mol |
| LogP | 5.0874 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.11542 |
| Heavy Atoms | 30 |
| Complexity | 1268.6843 |
Chemical Identifiers
| CAS Number | 22812-33-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)/C=C/C4=CC=CC=C4 |
Product Overview
2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate (CAS 22812-33-5), with molecular formula C25H18O5 and molecular weight 398.12 g/mol. IUPAC: [2-(4-methoxyphenyl)-4-oxochromen-3-yl] (E)-3-phenylprop-2-enoate.
Chemical Property Profile of 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate
Property Insights of 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate
The XLogP value of 5.0874 indicates that 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate. Following Lipinski's Rule of Five, 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate?
The CAS number of 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate is 22812-33-5.
What is the molecular formula of 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate?
The molecular formula of 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate is C25H18O5.
What is the molecular weight of 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate?
The molecular weight of 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate is 398.12 g/mol.
Where can I buy 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate?
You can request a quote for 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-methoxyphenyl)-4-oxo-4H-chromen-3-yl 3-phenylacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.