8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
TL;DR: 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 847846-70-2) is a chemical compound with molecular formula C15H16N4O4 and molecular weight 316.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(4-ethoxy-3-methoxyphenyl)-3-methyl-7H-purine-2,6-dione
Also Known As: 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-7H-purine-2,6-dione, 8-(4-ethoxy-3-methoxyphenyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C15H16N4O4 |
|---|---|
| Molecular Weight | 316.12 g/mol |
| LogP | 1.0242 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.11716 |
| Heavy Atoms | 23 |
| Complexity | 983.2861 |
Chemical Identifiers
| CAS Number | 847846-70-2 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2=NC3=C(N2)C(=O)NC(=O)N3C)OC |
Product Overview
8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 847846-70-2), with molecular formula C15H16N4O4 and molecular weight 316.12 g/mol. IUPAC: 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-7H-purine-2,6-dione.
Chemical Property Profile of 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
Property Insights of 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of 1.0242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione has 2 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 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione is 847846-70-2.
What is the molecular formula of 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione is C15H16N4O4.
What is the molecular weight of 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione is 316.12 g/mol.
Where can I buy 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-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 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-(4-ethoxy-3-methoxyphenyl)-3-methyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.