![7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione structure](/static/products/1556/1556019-89-6.webp)
7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione
TL;DR: 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione (CAS 1556019-89-6) is a chemical compound with molecular formula C11H14N4O2 and molecular weight 234.11168 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione
Also Known As: BAS 01547079, 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione, 7-But-2-enyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione, 7-(2-butenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 7-[(2E)-but-2-en-1-yl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Technical Specifications
| Molecular Formula | C11H14N4O2 |
| Molecular Weight | 234.11168 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 58.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.11168 Da |
| Heavy Atoms | 17 |
| Complexity | 368.0 |
| SMILES | C/C=C/CN1C=NC2=C1C(=O)N(C(=O)N2C)C |
| InChIKey | FPIVDSJDRKETAR-SNAWJCMRSA-N |
Chemical Property Profile of 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione
Property Insights of 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione. With a topological polar surface area (TPSA) of 58.4 Ų, 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione?
The CAS number of 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione is 1556019-89-6.
What is the molecular formula of 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione?
The molecular formula of 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione is C11H14N4O2.
What is the molecular weight of 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione?
The molecular weight of 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione is 234.11168 g/mol.
Where can I buy 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione?
You can request a quote for 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione?
Yes, CoreyChem provides custom synthesis services for 7-[(E)-but-2-enyl]-1,3-dimethylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.