N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide
TL;DR: N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide (CAS 878419-95-5) is a chemical compound with molecular formula C8H8N6OS and molecular weight 236.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide
Also Known As: BAS 12711444, N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide, 2-(1H-1,2,3-triazol-5-ylthio)-N-pyrimidin-2-ylacetamide, N-(pyrimidin-2-yl)-2-(1H-1,2,3-triazol-5-ylsulfanyl)acetamide, N-Pyrimidin-2-yl-2-(3H-[1,2,3]triazol-4-ylsulfanyl)-acetamide
| Molecular Formula | C8H8N6OS |
|---|---|
| Molecular Weight | 236.05 g/mol |
| LogP | 0.3255 |
| Topological Polar Surface Area | 96.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.04803 |
| Heavy Atoms | 16 |
| Complexity | 444.8168 |
Chemical Identifiers
| CAS Number | 878419-95-5 |
|---|---|
| SMILES | C1=CN=C(N=C1)NC(=O)CSC2=NNN=C2 |
Product Overview
N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide (CAS 878419-95-5), with molecular formula C8H8N6OS and molecular weight 236.05 g/mol. IUPAC: N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide.
Chemical Property Profile of N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide
Property Insights of N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide
The XLogP value of 0.3255 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide. The TPSA of 96.45 Ų falls within the moderate polarity range, balancing permeability and solubility for N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide. Following Lipinski's Rule of Five, N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide has 2 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 N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide?
The CAS number of N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide is 878419-95-5.
What is the molecular formula of N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide?
The molecular formula of N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide is C8H8N6OS.
What is the molecular weight of N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide?
The molecular weight of N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide is 236.05 g/mol.
Where can I buy N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide?
You can request a quote for N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-pyrimidin-2-yl-2-(2H-triazol-4-ylsulfanyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.