3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate
TL;DR: 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate (CAS 637749-97-4) is a chemical compound with molecular formula C26H20O6 and molecular weight 428.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(3,4-dimethoxyphenyl)-4-oxochromen-7-yl] (E)-3-phenylprop-2-enoate
Also Known As: 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate, VU0510286-1, 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl (2E)-3-phenylprop-2-enoate, F3139-1573, [3-(3,4-dimethoxyphenyl)-4-oxochromen-7-yl] (E)-3-phenylprop-2-enoate
| Molecular Formula | C26H20O6 |
|---|---|
| Molecular Weight | 428.13 g/mol |
| LogP | 5.096 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 428.12598 |
| Heavy Atoms | 32 |
| Complexity | 1352.1157 |
Chemical Identifiers
| CAS Number | 637749-97-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OC(=O)/C=C/C4=CC=CC=C4)OC |
Product Overview
3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate (CAS 637749-97-4), with molecular formula C26H20O6 and molecular weight 428.13 g/mol. IUPAC: [3-(3,4-dimethoxyphenyl)-4-oxochromen-7-yl] (E)-3-phenylprop-2-enoate.
Chemical Property Profile of 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate
Property Insights of 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate
The XLogP value of 5.096 indicates that 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate. Following Lipinski's Rule of Five, 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate?
The CAS number of 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate is 637749-97-4.
What is the molecular formula of 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate?
The molecular formula of 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate is C26H20O6.
What is the molecular weight of 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate?
The molecular weight of 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate is 428.13 g/mol.
Where can I buy 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate?
You can request a quote for 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl cinnamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.