3-methyl-8-phenyl-7H-purine-2,6-dione
TL;DR: 3-methyl-8-phenyl-7H-purine-2,6-dione (CAS 2850-34-2) is a chemical compound with molecular formula C12H10N4O2 and molecular weight 242.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-8-phenyl-7H-purine-2,6-dione
Also Known As: 3-Methyl-8-phenylxanthine, 3-methyl-8-phenyl-7H-purine-2,6-dione, 3-Methyl-8-phenyl-3,7-dihydro-purine-2,6-dione, 3,7-Dihydro-3-methyl-8-phenyl-1H-purine-2,6-dione, 3-Methyl-8-phenyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C12H10N4O2 |
|---|---|
| Molecular Weight | 242.08 g/mol |
| LogP | 0.6169 |
| Topological Polar Surface Area | 83.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 242.08037 |
| Heavy Atoms | 18 |
| Complexity | 826.64496 |
Chemical Identifiers
| CAS Number | 2850-34-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)NC(=N2)C3=CC=CC=C3 |
Product Overview
3-methyl-8-phenyl-7H-purine-2,6-dione (CAS 2850-34-2), with molecular formula C12H10N4O2 and molecular weight 242.08 g/mol. IUPAC: 3-methyl-8-phenyl-7H-purine-2,6-dione.
Chemical Property Profile of 3-methyl-8-phenyl-7H-purine-2,6-dione
Property Insights of 3-methyl-8-phenyl-7H-purine-2,6-dione
The XLogP value of 0.6169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-8-phenyl-7H-purine-2,6-dione. The TPSA of 83.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-8-phenyl-7H-purine-2,6-dione. Following Lipinski's Rule of Five, 3-methyl-8-phenyl-7H-purine-2,6-dione has 2 hydrogen bond donor(s) and 3 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 3-methyl-8-phenyl-7H-purine-2,6-dione?
The CAS number of 3-methyl-8-phenyl-7H-purine-2,6-dione is 2850-34-2.
What is the molecular formula of 3-methyl-8-phenyl-7H-purine-2,6-dione?
The molecular formula of 3-methyl-8-phenyl-7H-purine-2,6-dione is C12H10N4O2.
What is the molecular weight of 3-methyl-8-phenyl-7H-purine-2,6-dione?
The molecular weight of 3-methyl-8-phenyl-7H-purine-2,6-dione is 242.08 g/mol.
Where can I buy 3-methyl-8-phenyl-7H-purine-2,6-dione?
You can request a quote for 3-methyl-8-phenyl-7H-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 3-methyl-8-phenyl-7H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-8-phenyl-7H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.