5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine
TL;DR: 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine (CAS 51646-20-9) is a chemical compound with molecular formula C11H16N4S and molecular weight 236.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dimethyl-2-(2-methylpropylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine
Also Known As: 5,7-Dimethyl-2-[(2-methylpropyl)thio][1,2,4]triazolo[1,5-a]pyrimidine, 5,7-dimethyl-2-[(2-methylpropyl)sulfanyl][1,2,4]triazolo[1,5-a]pyrimidine, A2786/0117775, 5,7-dimethyl-2-(2-methylpropylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine, 2-(isobutylthio)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
| Molecular Formula | C11H16N4S |
|---|---|
| Molecular Weight | 236.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 68.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.10957 |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 51646-20-9 |
|---|---|
| SMILES | CC1=CC(=NC2=NC(=NN12)SCC(C)C)C |
| InChIKey | XWDREPGJOBFESM-UHFFFAOYSA-N |
Product Overview
5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine (CAS 51646-20-9), with molecular formula C11H16N4S and molecular weight 236.11 g/mol. IUPAC: 5,7-dimethyl-2-(2-methylpropylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine.
Chemical Property Profile of 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine
Property Insights of 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine
The XLogP value of 3.1 indicates that 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine. Following Lipinski's Rule of Five, 5,7-Dimethyl-2-((2-methylpropyl)thio)(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 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine?
The CAS number of 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine is 51646-20-9.
What is the molecular formula of 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine?
The molecular formula of 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine is C11H16N4S.
What is the molecular weight of 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine?
The molecular weight of 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine is 236.11 g/mol.
Where can I buy 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine?
You can request a quote for 5,7-Dimethyl-2-((2-methylpropyl)thio)(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 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5,7-Dimethyl-2-((2-methylpropyl)thio)(1,2,4)triazolo(1,5-a)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.