7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
TL;DR: 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione (CAS 846591-63-7) is a chemical compound with molecular formula C20H19Cl2N5O3 and molecular weight 447.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2,4-dichlorophenyl)-2,4-dimethyl-6-(oxolan-2-ylmethyl)purino[7,8-a]imidazole-1,3-dione
Also Known As: 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-(tetrahydrofuran-2-ylmethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(2,4-dichlorophenyl)-2,4-dimethyl-6-(oxolan-2-ylmethyl)purino[7,8-a]imidazole-1,3-dione
| Molecular Formula | C20H19Cl2N5O3 |
|---|---|
| Molecular Weight | 447.09 g/mol |
| LogP | 2.8392 |
| Topological Polar Surface Area | 75.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 447.0865 |
| Heavy Atoms | 30 |
| Complexity | 1422.7362 |
Chemical Identifiers
| CAS Number | 846591-63-7 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CC4CCCO4)C5=C(C=C(C=C5)Cl)Cl |
Product Overview
7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione (CAS 846591-63-7), with molecular formula C20H19Cl2N5O3 and molecular weight 447.09 g/mol. IUPAC: 7-(2,4-dichlorophenyl)-2,4-dimethyl-6-(oxolan-2-ylmethyl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Property Insights of 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
The XLogP value of 2.8392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione. The TPSA of 75.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione. Following Lipinski's Rule of Five, 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-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 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione?
The CAS number of 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione is 846591-63-7.
What is the molecular formula of 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione?
The molecular formula of 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione is C20H19Cl2N5O3.
What is the molecular weight of 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione?
The molecular weight of 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione is 447.09 g/mol.
Where can I buy 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione?
You can request a quote for 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-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-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(2,4-dichlorophenyl)-1,3-dimethyl-8-((tetrahydrofuran-2-yl)methyl)-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.