![6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione structure](/static/products/879/879468-95-8.png)
6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione
TL;DR: 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione (CAS 879468-95-8) is a chemical compound with molecular formula C27H30FN5O3 and molecular weight 491.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione, 7-(4-fluorophenyl)-1,3-dimethyl-8-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)ethyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 8-(2-((3s,5s,7s)-adamantan-1-yloxy)ethyl)-7-(4-fluorophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
| Molecular Formula | C27H30FN5O3 |
|---|---|
| Molecular Weight | 491.23 g/mol |
| LogP | 3.4779 |
| Topological Polar Surface Area | 75.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 491.23328 |
| Heavy Atoms | 36 |
| Complexity | 1588.5598 |
Chemical Identifiers
| CAS Number | 879468-95-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCOC45CC6CC(C4)CC(C6)C5)C7=CC=C(C=C7)F |
Product Overview
6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione (CAS 879468-95-8), with molecular formula C27H30FN5O3 and molecular weight 491.23 g/mol. IUPAC: 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione
Property Insights of 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione
The XLogP value of 3.4779 indicates that 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione. Following Lipinski's Rule of Five, 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione has 0 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 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione?
The CAS number of 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione is 879468-95-8.
What is the molecular formula of 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione?
The molecular formula of 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione is C27H30FN5O3.
What is the molecular weight of 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione?
The molecular weight of 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione is 491.23 g/mol.
Where can I buy 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione?
You can request a quote for 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-[2-(1-adamantyloxy)ethyl]-7-(4-fluorophenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.