1,7-dimethyl-8-phenyl-3H-purine-2,6-dione
TL;DR: 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione (CAS 343348-00-5) is a chemical compound with molecular formula C13H12N4O2 and molecular weight 256.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,7-dimethyl-8-phenyl-3H-purine-2,6-dione
Also Known As: 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione, 1,7-dimethyl-8-phenyl-3,7-dihydro-1H-purine-2,6-dione, AB-323/13887526
| Molecular Formula | C13H12N4O2 |
|---|---|
| Molecular Weight | 256.10 g/mol |
| LogP | 0.6273 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 256.09604 |
| Heavy Atoms | 19 |
| Complexity | 871.27997 |
Chemical Identifiers
| CAS Number | 343348-00-5 |
|---|---|
| SMILES | CN1C2=C(NC(=O)N(C2=O)C)N=C1C3=CC=CC=C3 |
Product Overview
1,7-dimethyl-8-phenyl-3H-purine-2,6-dione (CAS 343348-00-5), with molecular formula C13H12N4O2 and molecular weight 256.10 g/mol. IUPAC: 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione.
Chemical Property Profile of 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione
Property Insights of 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione
The XLogP value of 0.6273 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione. Following Lipinski's Rule of Five, 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione has 1 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 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione?
The CAS number of 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione is 343348-00-5.
What is the molecular formula of 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione?
The molecular formula of 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione is C13H12N4O2.
What is the molecular weight of 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione?
The molecular weight of 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione is 256.10 g/mol.
Where can I buy 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione?
You can request a quote for 1,7-dimethyl-8-phenyl-3H-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 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,7-dimethyl-8-phenyl-3H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.