![N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide structure](/static/products/2700/270087-01-9.webp)
N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide
TL;DR: N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide (CAS 270087-01-9) is a chemical compound with molecular formula C12H10ClF3N4OS and molecular weight 350.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
| Molecular Formula | C12H10ClF3N4OS |
|---|---|
| Molecular Weight | 350.02 g/mol |
| LogP | 3.2181 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.0216 |
| Heavy Atoms | 22 |
| Complexity | 689.25116 |
Chemical Identifiers
| CAS Number | 270087-01-9 |
|---|---|
| SMILES | CN1C=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl |
Product Overview
N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide (CAS 270087-01-9), with molecular formula C12H10ClF3N4OS and molecular weight 350.02 g/mol. IUPAC: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide
Property Insights of N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide
The XLogP value of 3.2181 indicates that N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide has 1 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 N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide?
The CAS number of N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide is 270087-01-9.
What is the molecular formula of N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide?
The molecular formula of N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide is C12H10ClF3N4OS.
What is the molecular weight of N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide?
The molecular weight of N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide is 350.02 g/mol.
Where can I buy N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide?
You can request a quote for N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-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 N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.