8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione
TL;DR: 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione (CAS 141794-40-3) is a chemical compound with molecular formula C10H13BrN4O3 and molecular weight 316.0171 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione
Also Known As: 8-bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione, BAS 02080977, 8-bromo-7-(2-methoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 8-bromo-7-(2-methoxyethyl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione, AB00584827-05
Technical Specifications
| Molecular Formula | C10H13BrN4O3 |
| Molecular Weight | 316.0171 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 67.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.0171 Da |
| Heavy Atoms | 18 |
| Complexity | 367.0 |
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CCOC |
| InChIKey | SKPLUIJEVGJUPN-UHFFFAOYSA-N |
Chemical Property Profile of 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione
Property Insights of 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione. Following Lipinski's Rule of Five, 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-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
What is the CAS number of 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione?
The CAS number of 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione is 141794-40-3.
What is the molecular formula of 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione?
The molecular formula of 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione is C10H13BrN4O3.
What is the molecular weight of 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione?
The molecular weight of 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione is 316.0171 g/mol.
Where can I buy 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione?
You can request a quote for 8-Bromo-7-(2-methoxyethyl)-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 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione?
Yes, CoreyChem provides custom synthesis services for 8-Bromo-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.