8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
TL;DR: 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (CAS 111038-25-6) is a chemical compound with molecular formula C10H15N5O4 and molecular weight 269.1124 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-amino-7-(2,3-dihydroxypropyl)-1,3-dimethylpurine-2,6-dione
Also Known As: 7-(2,3-Dihydroxypropyl)-8-aminotheophylline, 8-amino-7-(2,3-dihydroxypropyl)-1,3-dimethylpurine-2,6-dione, 3,7-Dihydro-8-amino-7-(2,3-dihydroxypropyl)-1,3-dimethyl-1H-purine-2,6-dione, 1H-Purine-2,6-dione, 3,7-dihydro-8-amino-7-(2,3-dihydroxypropyl)-1,3-dimethyl-, 8-AMINO-7-(2,3-DIHYDROXYPROPYL)-1,3-DIMETHYL-PURINE-2,6-DIONE
Technical Specifications
| Molecular Formula | C10H15N5O4 |
| Molecular Weight | 269.1124 g/mol |
| XLogP | -2.2 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.1124 Da |
| Heavy Atoms | 19 |
| Complexity | 392.0 |
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N)CC(CO)O |
| InChIKey | GYPQWFJSLDOPMK-UHFFFAOYSA-N |
Chemical Property Profile of 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
Property Insights of 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
The XLogP value of -2.2 indicates that 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione?
The CAS number of 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione is 111038-25-6.
What is the molecular formula of 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione?
The molecular formula of 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione is C10H15N5O4.
What is the molecular weight of 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione?
The molecular weight of 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione is 269.1124 g/mol.
Where can I buy 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione?
You can request a quote for 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione?
Yes, CoreyChem provides custom synthesis services for 8-Amino-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.