2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide
TL;DR: 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide (CAS 489415-45-4) is a chemical compound with molecular formula C14H21N5O3S and molecular weight 339.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide
Also Known As: 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide, 2-((1,3-dimethyl-2,6-dioxo-7-pentyl-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)acetamide, 2-[(1,3-dimethyl-2,6-dioxo-7-pentyl-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
| Molecular Formula | C14H21N5O3S |
|---|---|
| Molecular Weight | 339.14 g/mol |
| LogP | 0.2013 |
| Topological Polar Surface Area | 104.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 339.1365 |
| Heavy Atoms | 23 |
| Complexity | 848.6855 |
Chemical Identifiers
| CAS Number | 489415-45-4 |
|---|---|
| SMILES | CCCCCN1C2=C(N=C1SCC(=O)N)N(C(=O)N(C2=O)C)C |
Product Overview
2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide (CAS 489415-45-4), with molecular formula C14H21N5O3S and molecular weight 339.14 g/mol. IUPAC: 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide.
Chemical Property Profile of 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide
Property Insights of 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide
The XLogP value of 0.2013 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide. The TPSA of 104.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide. Following Lipinski's Rule of Five, 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide 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 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide?
The CAS number of 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide is 489415-45-4.
What is the molecular formula of 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide?
The molecular formula of 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide is C14H21N5O3S.
What is the molecular weight of 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide?
The molecular weight of 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide is 339.14 g/mol.
Where can I buy 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide?
You can request a quote for 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)sulfanylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.