![8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione structure](/static/products/7008/700860-55-5.webp)
8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
TL;DR: 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione (CAS 700860-55-5) is a chemical compound with molecular formula C21H17Cl2FN4O3 and molecular weight 462.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
Also Known As: 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione, 8-((2,4-dichlorobenzyl)oxy)-7-(4-fluorobenzyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethyl-purine-2,6-dione, 8-[(2,4-dichlorobenzyl)oxy]-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C21H17Cl2FN4O3 |
|---|---|
| Molecular Weight | 462.07 g/mol |
| LogP | 3.5069 |
| Topological Polar Surface Area | 71.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 462.06616 |
| Heavy Atoms | 31 |
| Complexity | 1407.6454 |
Chemical Identifiers
| CAS Number | 700860-55-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OCC3=C(C=C(C=C3)Cl)Cl)CC4=CC=C(C=C4)F |
Product Overview
8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione (CAS 700860-55-5), with molecular formula C21H17Cl2FN4O3 and molecular weight 462.07 g/mol. IUPAC: 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
Property Insights of 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
The XLogP value of 3.5069 indicates that 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione. Following Lipinski's Rule of Five, 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-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
Frequently Asked Questions
What is the CAS number of 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione?
The CAS number of 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione is 700860-55-5.
What is the molecular formula of 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione?
The molecular formula of 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione is C21H17Cl2FN4O3.
What is the molecular weight of 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione?
The molecular weight of 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione is 462.07 g/mol.
Where can I buy 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione?
You can request a quote for 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-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 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-[(2,4-dichlorophenyl)methoxy]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.