![4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one structure](/static/products/841/841216-82-8.png)
4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
TL;DR: 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one (CAS 841216-82-8) is a chemical compound with molecular formula C17H19N5O2S and molecular weight 357.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-1-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one
Also Known As: 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one, 4-methyl-1-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one, 4-methyl-1-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
| Molecular Formula | C17H19N5O2S |
|---|---|
| Molecular Weight | 357.13 g/mol |
| LogP | 1.6858 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.12595 |
| Heavy Atoms | 25 |
| Complexity | 1003.34973 |
Chemical Identifiers
| CAS Number | 841216-82-8 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC(=O)N4CCCCC4 |
Product Overview
4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one (CAS 841216-82-8), with molecular formula C17H19N5O2S and molecular weight 357.13 g/mol. IUPAC: 4-methyl-1-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one.
Chemical Property Profile of 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Property Insights of 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
The XLogP value of 1.6858 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one. Following Lipinski's Rule of Five, 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one has 0 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 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one?
The CAS number of 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one is 841216-82-8.
What is the molecular formula of 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one?
The molecular formula of 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one is C17H19N5O2S.
What is the molecular weight of 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one?
The molecular weight of 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one is 357.13 g/mol.
Where can I buy 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one?
You can request a quote for 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-1-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.