![7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione structure](/static/products/877/877806-66-1.png)
7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione
TL;DR: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione (CAS 877806-66-1) is a chemical compound with molecular formula C19H20N6O4 and molecular weight 396.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione
Also Known As: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione, 6-hydroxy-7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)-3,7-dihydro-2H-purin-2-one, 7-(4-methoxyphenethyl)-3-methyl-8-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C19H20N6O4 |
|---|---|
| Molecular Weight | 396.15 g/mol |
| LogP | 0.7872 |
| Topological Polar Surface Area | 114.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.1546 |
| Heavy Atoms | 29 |
| Complexity | 1248.6705 |
Chemical Identifiers
| CAS Number | 877806-66-1 |
|---|---|
| SMILES | CC1=NN(C(=O)C1)C2=NC3=C(N2CCC4=CC=C(C=C4)OC)C(=O)NC(=O)N3C |
Product Overview
7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione (CAS 877806-66-1), with molecular formula C19H20N6O4 and molecular weight 396.15 g/mol. IUPAC: 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione.
Chemical Property Profile of 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione
Property Insights of 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione
The XLogP value of 0.7872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione. The TPSA of 114.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione. Following Lipinski's Rule of Five, 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione has 1 hydrogen bond donor(s) and 6 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-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione?
The CAS number of 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione is 877806-66-1.
What is the molecular formula of 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione?
The molecular formula of 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione is C19H20N6O4.
What is the molecular weight of 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione?
The molecular weight of 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione is 396.15 g/mol.
Where can I buy 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione?
You can request a quote for 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)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-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-[2-(4-methoxyphenyl)ethyl]-3-methyl-8-(3-methyl-5-oxo-4H-pyrazol-1-yl)purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.