Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
TL;DR: Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate (CAS 6327-55-5) is a chemical compound with molecular formula C21H22O7 and molecular weight 386.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Also Known As: ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate, ethyl (E)-3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl
| Molecular Formula | C21H22O7 |
|---|---|
| Molecular Weight | 386.14 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 386.13657 |
| Heavy Atoms | 28 |
| Complexity | 535.0 |
Chemical Identifiers
| CAS Number | 6327-55-5 |
|---|---|
| SMILES | CCOC(=O)C=C(C1=CC2=C(C=C1)OCO2)C3=CC(=C(C(=C3)OC)OC)OC |
| InChIKey | GSLVHRJQSGDWJF-UHFFFAOYSA-N |
Product Overview
Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate (CAS 6327-55-5), with molecular formula C21H22O7 and molecular weight 386.14 g/mol. IUPAC: ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate.
Chemical Property Profile of Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Property Insights of Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
The XLogP value of 4.2 indicates that Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate. Following Lipinski's Rule of Five, Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate has 0 hydrogen bond donor(s) and 7 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 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate?
The CAS number of Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate is 6327-55-5.
What is the molecular formula of Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate?
The molecular formula of Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate is C21H22O7.
What is the molecular weight of Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate?
The molecular weight of Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate is 386.14 g/mol.
Where can I buy Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate?
You can request a quote for Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(1,3-benzodioxol-5-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.