![1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone structure](/static/products/895/895360-70-0.png)
1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone
TL;DR: 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone (CAS 895360-70-0) is a chemical compound with molecular formula C12H12N4OS and molecular weight 260.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone
Also Known As: 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone, 1-[5,7-dimethyl-2-(prop-2-yn-1-ylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone, 1-(5,7-dimethyl-2-(prop-2-yn-1-ylthio)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone, 6-acetyl-5,7-dimethyl-2-prop-2-ynylthio-8-hydro-1,2,4-triazolo[1,5-a]pyrimidin e
| Molecular Formula | C12H12N4OS |
|---|---|
| Molecular Weight | 260.07 g/mol |
| LogP | 1.66904 |
| Topological Polar Surface Area | 60.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.07318 |
| Heavy Atoms | 18 |
| Complexity | 668.74774 |
Chemical Identifiers
| CAS Number | 895360-70-0 |
|---|---|
| SMILES | CC1=C(C(=NC2=NC(=NN12)SCC#C)C)C(=O)C |
Product Overview
1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone (CAS 895360-70-0), with molecular formula C12H12N4OS and molecular weight 260.07 g/mol. IUPAC: 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone.
Chemical Property Profile of 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone
Property Insights of 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone
The XLogP value of 1.66904 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone. The TPSA of 60.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone. Following Lipinski's Rule of Five, 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone 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 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone?
The CAS number of 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone is 895360-70-0.
What is the molecular formula of 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone?
The molecular formula of 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone is C12H12N4OS.
What is the molecular weight of 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone?
The molecular weight of 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone is 260.07 g/mol.
Where can I buy 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone?
You can request a quote for 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(5,7-dimethyl-2-prop-2-ynylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.