![7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione structure](/static/products/849/849025-95-2.png)
7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
TL;DR: 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione (CAS 849025-95-2) is a chemical compound with molecular formula C25H23N5O4 and molecular weight 457.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(1,3-benzodioxol-5-yl)-2,4-dimethyl-6-(4-propan-2-ylphenyl)purino[7,8-a]imidazole-1,3-dione
Also Known As: 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(1,3-benzodioxol-5-yl)-2,4-dimethyl-6-(4-propan-2-ylphenyl)purino[7,8-a]imidazole-1,3-dione, 7-(benzo[d][1,3]dioxol-5-yl)-8-(4-isopropylphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
| Molecular Formula | C25H23N5O4 |
|---|---|
| Molecular Weight | 457.18 g/mol |
| LogP | 3.1947 |
| Topological Polar Surface Area | 84.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 457.17502 |
| Heavy Atoms | 34 |
| Complexity | 1717.4365 |
Chemical Identifiers
| CAS Number | 849025-95-2 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C)C5=CC6=C(C=C5)OCO6 |
Product Overview
7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione (CAS 849025-95-2), with molecular formula C25H23N5O4 and molecular weight 457.18 g/mol. IUPAC: 7-(1,3-benzodioxol-5-yl)-2,4-dimethyl-6-(4-propan-2-ylphenyl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Property Insights of 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
The XLogP value of 3.1947 indicates that 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione. Following Lipinski's Rule of Five, 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione has 0 hydrogen bond donor(s) and 5 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-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione?
The CAS number of 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione is 849025-95-2.
What is the molecular formula of 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione?
The molecular formula of 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione is C25H23N5O4.
What is the molecular weight of 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione?
The molecular weight of 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione is 457.18 g/mol.
Where can I buy 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione?
You can request a quote for 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-[4-(propan-2-yl)phenyl]-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.