7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione
TL;DR: 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 672265-76-8) is a chemical compound with molecular formula C16H18ClN5O3 and molecular weight 363.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2-chlorophenyl)methyl]-8-(2-methoxyethylamino)-3-methylpurine-2,6-dione
Also Known As: BAS 05968897, UPCMLD0ENAT5733391:001, AB01299170-01, 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione, 7-(2-chlorobenzyl)-8-[(2-methoxyethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C16H18ClN5O3 |
|---|---|
| Molecular Weight | 363.11 g/mol |
| LogP | 1.1833 |
| Topological Polar Surface Area | 93.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.1098 |
| Heavy Atoms | 25 |
| Complexity | 1020.7626 |
Chemical Identifiers
| CAS Number | 672265-76-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCOC)CC3=CC=CC=C3Cl |
Product Overview
7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 672265-76-8), with molecular formula C16H18ClN5O3 and molecular weight 363.11 g/mol. IUPAC: 7-[(2-chlorophenyl)methyl]-8-(2-methoxyethylamino)-3-methylpurine-2,6-dione.
Chemical Property Profile of 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione
Property Insights of 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of 1.1833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione. The TPSA of 93.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-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
Frequently Asked Questions
What is the CAS number of 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione is 672265-76-8.
What is the molecular formula of 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione is C16H18ClN5O3.
What is the molecular weight of 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione is 363.11 g/mol.
Where can I buy 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-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-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.