N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide
TL;DR: N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide (CAS 539808-41-8) is a chemical compound with molecular formula C29H32N4O2S and molecular weight 500.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-phenyl-5-[(4-propylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide
Also Known As: A3077/0130127, N-MESITYL-2-((4-PH-5-((4-PROPYLPHENOXY)ME)-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETAMIDE, N-Mesityl-2-((4-phenyl-5-((4-propylphenoxy)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, 2-[[4-phenyl-5-[(4-propylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide, 644-721-4
| Molecular Formula | C29H32N4O2S |
|---|---|
| Molecular Weight | 500.22 g/mol |
| LogP | 6.45486 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 500.2246 |
| Heavy Atoms | 36 |
| Complexity | 1294.1161 |
Chemical Identifiers
| CAS Number | 539808-41-8 |
|---|---|
| SMILES | CCCC1=CC=C(C=C1)OCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=C(C=C(C=C4C)C)C |
Product Overview
N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide (CAS 539808-41-8), with molecular formula C29H32N4O2S and molecular weight 500.22 g/mol. IUPAC: 2-[[4-phenyl-5-[(4-propylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide.
Chemical Property Profile of N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide
Property Insights of N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide
The XLogP value of 6.45486 indicates that N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide. Following Lipinski's Rule of Five, N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide?
The CAS number of N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide is 539808-41-8.
What is the molecular formula of N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide?
The molecular formula of N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide is C29H32N4O2S.
What is the molecular weight of N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide?
The molecular weight of N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide is 500.22 g/mol.
Where can I buy N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide?
You can request a quote for N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-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-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-Mesityl-2-((4-PH-5-((4-propylphenoxy)ME)-4H-1,2,4-triazol-3-YL)thio)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.