8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS 53782-22-2) is a chemical compound with molecular formula C8H9N7O2 and molecular weight 235.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-azido-1,3,7-trimethylpurine-2,6-dione
Also Known As: 8-azido-1,3,7-trimethylpurine-2,6-dione, 8-azido-1,3,7-trimethyl-purine-2,6-dione, 8-azido-1,3,7-trimethyl-1H-purine-2,6(3H,7H)-dione, 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C8H9N7O2 |
|---|---|
| Molecular Weight | 235.08 g/mol |
| LogP | -0.0875 |
| Topological Polar Surface Area | 110.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.08177 |
| Heavy Atoms | 17 |
| Complexity | 771.73834 |
Chemical Identifiers
| CAS Number | 53782-22-2 |
|---|---|
| SMILES | CN1C2=C(N=C1N=[N+]=[N-])N(C(=O)N(C2=O)C)C |
Product Overview
8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione (CAS 53782-22-2), with molecular formula C8H9N7O2 and molecular weight 235.08 g/mol. IUPAC: 8-azido-1,3,7-trimethylpurine-2,6-dione.
Chemical Property Profile of 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of -0.0875 indicates that 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione has 0 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-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione is 53782-22-2.
What is the molecular formula of 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione is C8H9N7O2.
What is the molecular weight of 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione is 235.08 g/mol.
Where can I buy 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-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 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-azido-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.