7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
TL;DR: 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 304878-68-0) is a chemical compound with molecular formula C22H21Cl2N5O3 and molecular weight 473.10214 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-[(2,6-dichlorophenyl)methyl]-8-[(2-hydroxy-2-phenylethyl)amino]-1,3-dimethylpurine-2,6-dione
Also Known As: 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 7-(2,6-dichlorobenzyl)-8-[(2-hydroxy-2-phenylethyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 7-[(2,6-dichlorophenyl)methyl]-8-[(2-hydroxy-2-phenylethyl)amino]-1,3-dimethylpurine-2,6-dione
Technical Specifications
| Molecular Formula | C22H21Cl2N5O3 |
| Molecular Weight | 473.10214 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 90.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 473.10214 Da |
| Heavy Atoms | 32 |
| Complexity | 684.0 |
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC(C3=CC=CC=C3)O)CC4=C(C=CC=C4Cl)Cl |
| InChIKey | RFRMFDKFBHQKBU-UHFFFAOYSA-N |
Chemical Property Profile of 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
Property Insights of 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of 3.6 indicates that 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is 304878-68-0.
What is the molecular formula of 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is C22H21Cl2N5O3.
What is the molecular weight of 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is 473.10214 g/mol.
Where can I buy 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione?
Yes, CoreyChem provides custom synthesis services for 7-(2,6-dichlorobenzyl)-8-((2-hydroxy-2-phenylethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.