7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione (CAS 359690-84-9) is a chemical compound with molecular formula C22H22N4O4 and molecular weight 406.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(4-methoxyphenyl)methyl]-1,3-dimethyl-8-(2-methylphenoxy)purine-2,6-dione
Also Known As: 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione, 7-(4-methoxybenzyl)-1,3-dimethyl-8-(o-tolyloxy)-1H-purine-2,6(3H,7H)-dione, 7-[(4-methoxyphenyl)methyl]-1,3-dimethyl-8-(2-methylphenoxy)purine-2,6-dione, 7-[(4-METHOXYPHENYL)METHYL]-1,3-DIMETHYL-8-(2-METHYLPHENOXY)-2,3,6,7-TETRAHYDRO-1H-PURINE-2,6-DIONE
| Molecular Formula | C22H22N4O4 |
|---|---|
| Molecular Weight | 406.16 g/mol |
| LogP | 2.59132 |
| Topological Polar Surface Area | 80.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.1641 |
| Heavy Atoms | 30 |
| Complexity | 1346.8082 |
Chemical Identifiers
| CAS Number | 359690-84-9 |
|---|---|
| SMILES | CC1=CC=CC=C1OC2=NC3=C(N2CC4=CC=C(C=C4)OC)C(=O)N(C(=O)N3C)C |
Product Overview
7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione (CAS 359690-84-9), with molecular formula C22H22N4O4 and molecular weight 406.16 g/mol. IUPAC: 7-[(4-methoxyphenyl)methyl]-1,3-dimethyl-8-(2-methylphenoxy)purine-2,6-dione.
Chemical Property Profile of 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 2.59132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-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-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-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-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione is 359690-84-9.
What is the molecular formula of 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione is C22H22N4O4.
What is the molecular weight of 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione is 406.16 g/mol.
Where can I buy 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-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-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(4-methoxybenzyl)-1,3-dimethyl-8-(2-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.