![8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione structure](/static/products/1515/151539-62-7.webp)
8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione
TL;DR: 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione (CAS 151539-62-7) is a chemical compound with molecular formula C21H24N4O4 and molecular weight 396.17975 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-[2-(1,3-benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione
Also Known As: (E)-7-Methyl-8-(3,4-methylenedioxystyryl)-1,3-dipropylxanthine, 1H-Purine-2,6-dione,8-[2-(1,3-benzodioxol-5-yl)ethenyl]-3,7-dihydro-7-methyl-1,3-dipropyl-, (E)-(9CI), 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(1,3-benzodioxol-5-yl)ethenyl)-1,3-dipropyl-7-methyl-, (E)-
Technical Specifications
| Molecular Formula | C21H24N4O4 |
| Molecular Weight | 396.17975 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 76.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.17975 Da |
| Heavy Atoms | 29 |
| Complexity | 657.0 |
| SMILES | CCCN1C2=C(C(=O)N(C1=O)CCC)N(C(=N2)C=CC3=CC4=C(C=C3)OCO4)C |
| InChIKey | WFCADBVZUZQONR-UHFFFAOYSA-N |
Chemical Property Profile of 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione
Property Insights of 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione
The XLogP value of 3.5 indicates that 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione. Following Lipinski's Rule of Five, 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione?
The CAS number of 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione is 151539-62-7.
What is the molecular formula of 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione?
The molecular formula of 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione is C21H24N4O4.
What is the molecular weight of 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione?
The molecular weight of 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione is 396.17975 g/mol.
Where can I buy 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione?
You can request a quote for 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione?
Yes, CoreyChem provides custom synthesis services for 8-[2-(1,3-Benzodioxol-5-yl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.