![2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide structure](/static/products/799/799810-63-2.png)
2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide
TL;DR: 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide (CAS 799810-63-2) is a chemical compound with molecular formula C26H23N5O2S2 and molecular weight 501.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(8-oxo-7-phenyl-15-thia-2,4,5,7-tetrazatetracyclo[7.6.0.02,6.010,14]pentadeca-1(9),3,5,10(14)-tetraen-3-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Also Known As: 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide, 2-[(5-oxo-4-phenyl-4,5,7,8-tetrahydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]-N-(2-phenylethyl)acetamide
| Molecular Formula | C26H23N5O2S2 |
|---|---|
| Molecular Weight | 501.13 g/mol |
| LogP | 4.0346 |
| Topological Polar Surface Area | 81.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 501.1293 |
| Heavy Atoms | 35 |
| Complexity | 1588.9116 |
Chemical Identifiers
| CAS Number | 799810-63-2 |
|---|---|
| SMILES | C1CC2=C(C1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)NCCC5=CC=CC=C5)C6=CC=CC=C6 |
Product Overview
2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide (CAS 799810-63-2), with molecular formula C26H23N5O2S2 and molecular weight 501.13 g/mol. IUPAC: 2-[(8-oxo-7-phenyl-15-thia-2,4,5,7-tetrazatetracyclo[7.6.0.02,6.010,14]pentadeca-1(9),3,5,10(14)-tetraen-3-yl)sulfanyl]-N-(2-phenylethyl)acetamide.
Chemical Property Profile of 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide
Property Insights of 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide
The XLogP value of 4.0346 indicates that 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide. Following Lipinski's Rule of Five, 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide?
The CAS number of 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide is 799810-63-2.
What is the molecular formula of 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide?
The molecular formula of 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide is C26H23N5O2S2.
What is the molecular weight of 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide?
The molecular weight of 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide is 501.13 g/mol.
Where can I buy 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide?
You can request a quote for 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)-N-phenethylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.