7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
TL;DR: 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 76620-50-3) is a chemical compound with molecular formula C9H12N4O3 and molecular weight 224.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-hydroxypropyl)-3-methylpurine-2,6-dione
Also Known As: 7-(2-hydroxypropyl)-3-methylpurine-2,6-dione, 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, 7-(2-hydroxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C9H12N4O3 |
|---|---|
| Molecular Weight | 224.09 g/mol |
| LogP | -1.1959 |
| Topological Polar Surface Area | 92.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.09094 |
| Heavy Atoms | 16 |
| Complexity | 634.222 |
Chemical Identifiers
| CAS Number | 76620-50-3 |
|---|---|
| SMILES | CC(CN1C=NC2=C1C(=O)NC(=O)N2C)O |
Product Overview
7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 76620-50-3), with molecular formula C9H12N4O3 and molecular weight 224.09 g/mol. IUPAC: 7-(2-hydroxypropyl)-3-methylpurine-2,6-dione.
Chemical Property Profile of 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
Property Insights of 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of -1.1959 indicates that 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione has 2 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 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione is 76620-50-3.
What is the molecular formula of 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione is C9H12N4O3.
What is the molecular weight of 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione is 224.09 g/mol.
Where can I buy 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-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-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.