8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
TL;DR: 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 840480-64-0) is a chemical compound with molecular formula C15H16N4O3 and molecular weight 300.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2-ethoxyphenyl)-1,3-dimethyl-7H-purine-2,6-dione
Also Known As: 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 8-(2-ethoxyphenyl)-1,3-dimethyl-7H-purine-2,6-dione, 8-(2-ethoxyphenyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
| Molecular Formula | C15H16N4O3 |
|---|---|
| Molecular Weight | 300.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.12225 |
| Heavy Atoms | 22 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 840480-64-0 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C2=NC3=C(N2)C(=O)N(C(=O)N3C)C |
| InChIKey | WTEDLIQOMIXNDI-UHFFFAOYSA-N |
Product Overview
8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 840480-64-0), with molecular formula C15H16N4O3 and molecular weight 300.12 g/mol. IUPAC: 8-(2-ethoxyphenyl)-1,3-dimethyl-7H-purine-2,6-dione.
Chemical Property Profile of 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
Property Insights of 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione has 1 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-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is 840480-64-0.
What is the molecular formula of 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is C15H16N4O3.
What is the molecular weight of 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is 300.12 g/mol.
Where can I buy 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 8-(2-ethoxyphenyl)-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 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-(2-ethoxyphenyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.