8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
TL;DR: 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 305865-28-5) is a chemical compound with molecular formula C16H17BrN4O5 and molecular weight 424.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-bromo-7-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-3-methylpurine-2,6-dione
Also Known As: 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, 8-bromo-7-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-3-methylpurine-2,6-dione
| Molecular Formula | C16H17BrN4O5 |
|---|---|
| Molecular Weight | 424.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.03824 |
| Heavy Atoms | 26 |
| Complexity | 539.0 |
Chemical Identifiers
| CAS Number | 305865-28-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CC(COC3=CC=CC=C3OC)O |
| InChIKey | GFPKNFGIIHGJCP-UHFFFAOYSA-N |
Product Overview
8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 305865-28-5), with molecular formula C16H17BrN4O5 and molecular weight 424.04 g/mol. IUPAC: 8-bromo-7-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-3-methylpurine-2,6-dione.
Chemical Property Profile of 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
Property Insights of 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione has 2 hydrogen bond donor(s) and 6 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-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione is 305865-28-5.
What is the molecular formula of 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione is C16H17BrN4O5.
What is the molecular weight of 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione is 424.04 g/mol.
Where can I buy 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-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 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-bromo-7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.