7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione
TL;DR: 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione (CAS 500143-94-2) is a chemical compound with molecular formula C20H20N4O3S and molecular weight 396.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-methoxyethyl)-3-methyl-8-(naphthalen-2-ylmethylsulfanyl)purine-2,6-dione
Also Known As: 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione, 7-(2-methoxyethyl)-3-methyl-8-(naphthalen-2-ylmethylsulfanyl)purine-2,6-dione, 6-hydroxy-7-(2-methoxyethyl)-3-methyl-8-[(naphthalen-2-ylmethyl)sulfanyl]-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C20H20N4O3S |
|---|---|
| Molecular Weight | 396.13 g/mol |
| LogP | 2.5152 |
| Topological Polar Surface Area | 81.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.1256 |
| Heavy Atoms | 28 |
| Complexity | 1272.1522 |
Chemical Identifiers
| CAS Number | 500143-94-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC3=CC4=CC=CC=C4C=C3)CCOC |
Product Overview
7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione (CAS 500143-94-2), with molecular formula C20H20N4O3S and molecular weight 396.13 g/mol. IUPAC: 7-(2-methoxyethyl)-3-methyl-8-(naphthalen-2-ylmethylsulfanyl)purine-2,6-dione.
Chemical Property Profile of 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione
Property Insights of 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione
The XLogP value of 2.5152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione. The TPSA of 81.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-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-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione?
The CAS number of 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione is 500143-94-2.
What is the molecular formula of 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione is C20H20N4O3S.
What is the molecular weight of 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione is 396.13 g/mol.
Where can I buy 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-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-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(2-methoxyethyl)-3-methyl-8-((naphthalen-2-ylmethyl)thio)-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.