7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS 476480-50-9) is a chemical compound with molecular formula C18H22N4O4 and molecular weight 358.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-8-(2-ethoxyethoxy)-1,3-dimethylpurine-2,6-dione
Also Known As: BAS 05914563, 7-benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, AB01304179-01, 7-benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, F1289-0106
| Molecular Formula | C18H22N4O4 |
|---|---|
| Molecular Weight | 358.16 g/mol |
| LogP | 0.8973 |
| Topological Polar Surface Area | 80.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.1641 |
| Heavy Atoms | 26 |
| Complexity | 1017.57764 |
Chemical Identifiers
| CAS Number | 476480-50-9 |
|---|---|
| SMILES | CCOCCOC1=NC2=C(N1CC3=CC=CC=C3)C(=O)N(C(=O)N2C)C |
Product Overview
7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS 476480-50-9), with molecular formula C18H22N4O4 and molecular weight 358.16 g/mol. IUPAC: 7-benzyl-8-(2-ethoxyethoxy)-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 0.8973 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 80.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-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
Frequently Asked Questions
What is the CAS number of 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione is 476480-50-9.
What is the molecular formula of 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione is C18H22N4O4.
What is the molecular weight of 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione is 358.16 g/mol.
Where can I buy 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-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 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-Benzyl-8-(2-ethoxyethoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.