![N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide structure](/static/products/3333/333323-54-9.webp)
N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide
TL;DR: N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide (CAS 333323-54-9) is a chemical compound with molecular formula C18H17BrN4OS and molecular weight 416.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-bromophenyl)acetamide
Also Known As: WAY-301276-10mMinDMSO,,, BAS 02223763, N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide, 2-((5-Benzyl-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(4-bromophenyl)acetamide, 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-bromophenyl)acetamide
| Molecular Formula | C18H17BrN4OS |
|---|---|
| Molecular Weight | 416.03 g/mol |
| LogP | 3.8992 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 416.03064 |
| Heavy Atoms | 25 |
| Complexity | 849.27246 |
Chemical Identifiers
| CAS Number | 333323-54-9 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)CC3=CC=CC=C3 |
Product Overview
N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide (CAS 333323-54-9), with molecular formula C18H17BrN4OS and molecular weight 416.03 g/mol. IUPAC: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-bromophenyl)acetamide.
Chemical Property Profile of N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide
Property Insights of N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide
The XLogP value of 3.8992 indicates that N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]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-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]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-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide?
The CAS number of N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide is 333323-54-9.
What is the molecular formula of N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide?
The molecular formula of N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide is C18H17BrN4OS.
What is the molecular weight of N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide?
The molecular weight of N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide is 416.03 g/mol.
Where can I buy N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide?
You can request a quote for N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromophenyl)-2-[4-methyl-5-benzyl(1,2,4-triazol-3-ylthio)]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.