7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
TL;DR: 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 359710-76-2) is a chemical compound with molecular formula C22H20Cl2N4O3 and molecular weight 458.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2,4-dichlorophenyl)methyl]-8-(4-ethylphenoxy)-1,3-dimethylpurine-2,6-dione
Also Known As: 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 7-[(2,4-dichlorophenyl)methyl]-8-(4-ethylphenoxy)-1,3-dimethyl-purine-2,6-dione, 7-[(2,4-dichlorophenyl)methyl]-8-(4-ethylphenoxy)-1,3-dimethylpurine-2,6-dione
| Molecular Formula | C22H20Cl2N4O3 |
|---|---|
| Molecular Weight | 458.09 g/mol |
| LogP | 4.1435 |
| Topological Polar Surface Area | 71.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 458.09125 |
| Heavy Atoms | 31 |
| Complexity | 1401.7766 |
Chemical Identifiers
| CAS Number | 359710-76-2 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)OC2=NC3=C(N2CC4=C(C=C(C=C4)Cl)Cl)C(=O)N(C(=O)N3C)C |
Product Overview
7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 359710-76-2), with molecular formula C22H20Cl2N4O3 and molecular weight 458.09 g/mol. IUPAC: 7-[(2,4-dichlorophenyl)methyl]-8-(4-ethylphenoxy)-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
Property Insights of 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of 4.1435 indicates that 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-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 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-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 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is 359710-76-2.
What is the molecular formula of 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is C22H20Cl2N4O3.
What is the molecular weight of 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is 458.09 g/mol.
Where can I buy 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(2,4-dichlorobenzyl)-8-(4-ethylphenoxy)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.