2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide
TL;DR: 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide (CAS 879477-18-6) is a chemical compound with molecular formula C14H15N7OS and molecular weight 329.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide, 2-{4-amino-5-[3-(4-methylphenyl)pyrazol-5-yl]-1,2,4-triazol-3-ylthio}acetamide, 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide, 2-[[4-amino-5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C14H15N7OS |
|---|---|
| Molecular Weight | 329.11 g/mol |
| LogP | 0.93482 |
| Topological Polar Surface Area | 128.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.10587 |
| Heavy Atoms | 23 |
| Complexity | 837.19025 |
Chemical Identifiers
| CAS Number | 879477-18-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC(=O)N |
Product Overview
2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide (CAS 879477-18-6), with molecular formula C14H15N7OS and molecular weight 329.11 g/mol. IUPAC: 2-[[4-amino-5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide
Property Insights of 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide
The XLogP value of 0.93482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide. The TPSA of 128.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide. Following Lipinski's Rule of Five, 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide has 3 hydrogen bond donor(s) and 6 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-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide?
The CAS number of 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide is 879477-18-6.
What is the molecular formula of 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide?
The molecular formula of 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide is C14H15N7OS.
What is the molecular weight of 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide?
The molecular weight of 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide is 329.11 g/mol.
Where can I buy 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide?
You can request a quote for 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-amino-5-(3-(p-tolyl)-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.