![2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile structure](/static/products/4436/443675-31-8.webp)
2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile
TL;DR: 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile (CAS 443675-31-8) is a chemical compound with molecular formula C12H9N5S and molecular weight 255.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetonitrile
Also Known As: 2-([2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl)acetonitrile, 2-(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile, 2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetonitrile, 2-({2-METHYL-[1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-YL}SULFANYL)ACETONITRILE
| Molecular Formula | C12H9N5S |
|---|---|
| Molecular Weight | 255.06 g/mol |
| LogP | 2.2016 |
| Topological Polar Surface Area | 66.87 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.05786 |
| Heavy Atoms | 18 |
| Complexity | 771.06964 |
Chemical Identifiers
| CAS Number | 443675-31-8 |
|---|---|
| SMILES | CC1=NN2C(=N1)C3=CC=CC=C3N=C2SCC#N |
Product Overview
2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile (CAS 443675-31-8), with molecular formula C12H9N5S and molecular weight 255.06 g/mol. IUPAC: 2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetonitrile.
Chemical Property Profile of 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile
Property Insights of 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile
The XLogP value of 2.2016 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile. The TPSA of 66.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile. Following Lipinski's Rule of Five, 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile 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 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile?
The CAS number of 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile is 443675-31-8.
What is the molecular formula of 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile?
The molecular formula of 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile is C12H9N5S.
What is the molecular weight of 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile?
The molecular weight of 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile is 255.06 g/mol.
Where can I buy 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile?
You can request a quote for 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-ylthio)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.