7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione
TL;DR: 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione (CAS 849910-76-5) is a chemical compound with molecular formula C22H27N7O4 and molecular weight 453.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione
Also Known As: 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione, 7-(2-hydroxy-3-phenoxy-propyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethyl-purine-2,6-dione, 7-(2-hydroxy-3-phenoxypropyl)-8-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 8-((3-(1H-imidazol-1-yl)propyl)amino)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C22H27N7O4 |
|---|---|
| Molecular Weight | 453.21 g/mol |
| LogP | 0.5723 |
| Topological Polar Surface Area | 121.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 453.21246 |
| Heavy Atoms | 33 |
| Complexity | 1323.0305 |
Chemical Identifiers
| CAS Number | 849910-76-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCCN3C=CN=C3)CC(COC4=CC=CC=C4)O |
Product Overview
7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione (CAS 849910-76-5), with molecular formula C22H27N7O4 and molecular weight 453.21 g/mol. IUPAC: 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione
Property Insights of 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione
The XLogP value of 0.5723 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione. The TPSA of 121.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione. Following Lipinski's Rule of Five, 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione has 2 hydrogen bond donor(s) and 7 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-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione?
The CAS number of 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione is 849910-76-5.
What is the molecular formula of 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione?
The molecular formula of 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione is C22H27N7O4.
What is the molecular weight of 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione?
The molecular weight of 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione is 453.21 g/mol.
Where can I buy 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione?
You can request a quote for 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-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 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(2-hydroxy-3-phenoxypropyl)-8-(3-imidazol-1-ylpropylamino)-1,3-dimethylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.