4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione
TL;DR: 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione (CAS 343348-04-9) is a chemical compound with molecular formula C10H16N4O5 and molecular weight 272.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethoxy-1,3,7-trimethyl-9H-purine-2,6,8-trione
Also Known As: NCIOpen2_006298, 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione, AB-323/13887544, 4,5-dimethoxy-1,3,7-trimethyl-9H-purine-2,6,8-trione, 4,5-dimethoxy-1,3,7-trimethyl-octahydro-1H-purine-2,6,8-trione
| Molecular Formula | C10H16N4O5 |
|---|---|
| Molecular Weight | 272.11 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 91.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.11206 |
| Heavy Atoms | 19 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 343348-04-9 |
|---|---|
| SMILES | CN1C(=O)C2(C(NC(=O)N2C)(N(C1=O)C)OC)OC |
| InChIKey | NDOKUOMWPDJOAX-UHFFFAOYSA-N |
Product Overview
4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione (CAS 343348-04-9), with molecular formula C10H16N4O5 and molecular weight 272.11 g/mol. IUPAC: 4,5-dimethoxy-1,3,7-trimethyl-9H-purine-2,6,8-trione.
Chemical Property Profile of 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione
Property Insights of 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione
The XLogP value of -1.8 indicates that 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione. Following Lipinski's Rule of Five, 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione has 1 hydrogen bond donor(s) and 5 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 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione?
The CAS number of 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione is 343348-04-9.
What is the molecular formula of 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione?
The molecular formula of 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione is C10H16N4O5.
What is the molecular weight of 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione?
The molecular weight of 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione is 272.11 g/mol.
Where can I buy 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione?
You can request a quote for 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 4,5-dimethoxy-1,3,7-trimethyltetrahydro-1H-purine-2,6,8(3H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.