![1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione structure](/static/products/1477/147700-33-2.webp)
1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione
TL;DR: 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione (CAS 147700-33-2) is a chemical compound with molecular formula C19H22N4O5 and molecular weight 386.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,7-trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione
Also Known As: (E)-8-(2,3,4-Trimethoxystyryl)caffeine, 1,3,7-trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione, 1H-Purine-2,6-dione,3,7-dihydro-1,3,7-trimethyl-8-[(1E)-2-(2,3,4-trimethoxyphenyl)ethenyl]-, (E)-8-(2-(2,3,4-Trimethoxyphenyl)ethenyl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione, 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(2,3,4-trimethoxyphenyl)ethenyl)-1,3,7-trimethyl-, (E)-
| Molecular Formula | C19H22N4O5 |
|---|---|
| Molecular Weight | 386.16 g/mol |
| LogP | 1.1669 |
| Topological Polar Surface Area | 89.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.15903 |
| Heavy Atoms | 28 |
| Complexity | 1199.9702 |
Chemical Identifiers
| CAS Number | 147700-33-2 |
|---|---|
| SMILES | CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)C=CC3=C(C(=C(C=C3)OC)OC)OC |
Product Overview
1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione (CAS 147700-33-2), with molecular formula C19H22N4O5 and molecular weight 386.16 g/mol. IUPAC: 1,3,7-trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione.
Chemical Property Profile of 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione
Property Insights of 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione
The XLogP value of 1.1669 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione. The TPSA of 89.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione. Following Lipinski's Rule of Five, 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione has 0 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 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione?
The CAS number of 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione is 147700-33-2.
What is the molecular formula of 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione?
The molecular formula of 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione is C19H22N4O5.
What is the molecular weight of 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione?
The molecular weight of 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione is 386.16 g/mol.
Where can I buy 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione?
You can request a quote for 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,3,7-Trimethyl-8-[2-(2,3,4-trimethoxyphenyl)ethenyl]purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.