![2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine structure](/static/products/4454/445420-92-8.webp)
2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
TL;DR: 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine (CAS 445420-92-8) is a chemical compound with molecular formula C9H12N4S and molecular weight 208.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine
Also Known As: 2-(ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine, AN-646/40633598, 2-ethylsulfanyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine, A3262/0138664, [1,2,4]Triazolo[1,5-a]pyrimidine, 2-ethylsulfanyl-5,7-dimethyl-
| Molecular Formula | C9H12N4S |
|---|---|
| Molecular Weight | 208.08 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 68.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.07826 |
| Heavy Atoms | 14 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 445420-92-8 |
|---|---|
| SMILES | CCSC1=NN2C(=CC(=NC2=N1)C)C |
| InChIKey | VZKKJPXQSNBRBR-UHFFFAOYSA-N |
Product Overview
2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine (CAS 445420-92-8), with molecular formula C9H12N4S and molecular weight 208.08 g/mol. IUPAC: 2-ethylsulfanyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine.
Chemical Property Profile of 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
Property Insights of 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine. Following Lipinski's Rule of Five, 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine has 0 hydrogen bond donor(s) and 4 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-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine?
The CAS number of 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine is 445420-92-8.
What is the molecular formula of 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine?
The molecular formula of 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine is C9H12N4S.
What is the molecular weight of 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine?
The molecular weight of 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine is 208.08 g/mol.
Where can I buy 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine?
You can request a quote for 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(Ethylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.