2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide
TL;DR: 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide (CAS 370078-49-2) is a chemical compound with molecular formula C24H25N5O6S and molecular weight 511.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[7-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-3-methyl-2,6-dioxopurin-8-yl]sulfanyl-N-phenylacetamide
Also Known As: 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide, 2-({7-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)-N-phenylacetamide, 2-[7-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-3-methyl-2,6-dioxopurin-8-yl]sulfanyl-N-phenylacetamide
| Molecular Formula | C24H25N5O6S |
|---|---|
| Molecular Weight | 511.15 g/mol |
| LogP | 1.6026 |
| Topological Polar Surface Area | 140.47 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 511.15256 |
| Heavy Atoms | 36 |
| Complexity | 1480.1265 |
Chemical Identifiers
| CAS Number | 370078-49-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(=O)NC3=CC=CC=C3)CC(COC4=CC=CC=C4OC)O |
Product Overview
2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide (CAS 370078-49-2), with molecular formula C24H25N5O6S and molecular weight 511.15 g/mol. IUPAC: 2-[7-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-3-methyl-2,6-dioxopurin-8-yl]sulfanyl-N-phenylacetamide.
Chemical Property Profile of 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide
Property Insights of 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide
The XLogP value of 1.6026 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide. The TPSA of 140.47 Ų indicates high polarity, suggesting 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide?
The CAS number of 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide is 370078-49-2.
What is the molecular formula of 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide?
The molecular formula of 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide is C24H25N5O6S.
What is the molecular weight of 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide?
The molecular weight of 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide is 511.15 g/mol.
Where can I buy 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide?
You can request a quote for 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((7-(2-hydroxy-3-(2-methoxyphenoxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.