![7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione structure](/static/products/587/587008-97-7.png)
7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione
TL;DR: 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione (CAS 587008-97-7) is a chemical compound with molecular formula C19H23Cl2N5O3 and molecular weight 439.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethylpurine-2,6-dione
Also Known As: 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione, 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethylpurine-2,6-dione, 7-(2,6-dichlorobenzyl)-8-((3-ethoxypropyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 7-(2,6-dichlorobenzyl)-8-[(3-ethoxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C19H23Cl2N5O3 |
|---|---|
| Molecular Weight | 439.12 g/mol |
| LogP | 2.6273 |
| Topological Polar Surface Area | 83.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 439.1178 |
| Heavy Atoms | 29 |
| Complexity | 1129.1729 |
Chemical Identifiers
| CAS Number | 587008-97-7 |
|---|---|
| SMILES | CCOCCCNC1=NC2=C(N1CC3=C(C=CC=C3Cl)Cl)C(=O)N(C(=O)N2C)C |
Product Overview
7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione (CAS 587008-97-7), with molecular formula C19H23Cl2N5O3 and molecular weight 439.12 g/mol. IUPAC: 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione
Property Insights of 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione
The XLogP value of 2.6273 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione. The TPSA of 83.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione. Following Lipinski's Rule of Five, 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione has 1 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-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione?
The CAS number of 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione is 587008-97-7.
What is the molecular formula of 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione?
The molecular formula of 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione is C19H23Cl2N5O3.
What is the molecular weight of 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione?
The molecular weight of 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione is 439.12 g/mol.
Where can I buy 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione?
You can request a quote for 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-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-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-[(2,6-dichlorophenyl)methyl]-8-(3-ethoxypropylamino)-1,3-dimethyl-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.