![1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione structure](/static/products/1552/155271-96-8.webp)
1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione
TL;DR: 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione (CAS 155271-96-8) is a chemical compound with molecular formula C19H21FN4O3 and molecular weight 372.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione
Also Known As: (E)-1,3-Diethyl-8-(3-fluoro-4-methoxystyryl)-7-methylxanthine, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-8-(2-(3-fluoro-4-methoxyphenyl)ethenyl)-7-methyl-, (E)-, 1H-Purine-2,6-dione,1,3-diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-3,7-dihydro-7-methyl-, (E)-(9CI)
| Molecular Formula | C19H21FN4O3 |
|---|---|
| Molecular Weight | 372.16 g/mol |
| LogP | 2.2546 |
| Topological Polar Surface Area | 71.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.15976 |
| Heavy Atoms | 27 |
| Complexity | 1154.4419 |
Chemical Identifiers
| CAS Number | 155271-96-8 |
|---|---|
| SMILES | CCN1C2=C(C(=O)N(C1=O)CC)N(C(=N2)C=CC3=CC(=C(C=C3)OC)F)C |
Product Overview
1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione (CAS 155271-96-8), with molecular formula C19H21FN4O3 and molecular weight 372.16 g/mol. IUPAC: 1,3-diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione.
Chemical Property Profile of 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione
Property Insights of 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione
The XLogP value of 2.2546 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione. The TPSA of 71.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione. Following Lipinski's Rule of Five, 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione has 0 hydrogen bond donor(s) and 4 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-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione?
The CAS number of 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione is 155271-96-8.
What is the molecular formula of 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione?
The molecular formula of 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione is C19H21FN4O3.
What is the molecular weight of 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione?
The molecular weight of 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione is 372.16 g/mol.
Where can I buy 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione?
You can request a quote for 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-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-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diethyl-8-[2-(3-fluoro-4-methoxyphenyl)ethenyl]-7-methylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.