2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide
TL;DR: 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide (CAS 848989-01-5) is a chemical compound with molecular formula C25H26N4O2S and molecular weight 446.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(furan-2-ylmethyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide
Also Known As: 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide, 2-[[4-(furan-2-ylmethyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide, 2-{[4-(furan-2-ylmethyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
| Molecular Formula | C25H26N4O2S |
|---|---|
| Molecular Weight | 446.18 g/mol |
| LogP | 5.55088 |
| Topological Polar Surface Area | 72.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 446.17764 |
| Heavy Atoms | 32 |
| Complexity | 1204.5729 |
Chemical Identifiers
| CAS Number | 848989-01-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CO3)SCC(=O)NC4=C(C=C(C=C4C)C)C |
Product Overview
2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide (CAS 848989-01-5), with molecular formula C25H26N4O2S and molecular weight 446.18 g/mol. IUPAC: 2-[[4-(furan-2-ylmethyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide.
Chemical Property Profile of 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide
Property Insights of 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide
The XLogP value of 5.55088 indicates that 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide. Following Lipinski's Rule of Five, 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide 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 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide?
The CAS number of 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide is 848989-01-5.
What is the molecular formula of 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide?
The molecular formula of 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide is C25H26N4O2S.
What is the molecular weight of 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide?
The molecular weight of 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide is 446.18 g/mol.
Where can I buy 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide?
You can request a quote for 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-(furan-2-ylmethyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.