(Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide
TL;DR: (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide (CAS 303107-30-4) is a chemical compound with molecular formula C29H31N5O2S and molecular weight 513.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]acetamide
Also Known As: (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide, 2-[[5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]acetamide, N-[(1Z)-2-(4-methoxyphenyl)-1-azaprop-1-enyl]-2-{5-[4-(tert-butyl)phenyl]-4-ph enyl(1,2,4-triazol-3-ylthio)}acetamide
| Molecular Formula | C29H31N5O2S |
|---|---|
| Molecular Weight | 513.22 g/mol |
| LogP | 5.8729 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 513.21985 |
| Heavy Atoms | 37 |
| Complexity | 1372.8267 |
Chemical Identifiers
| CAS Number | 303107-30-4 |
|---|---|
| SMILES | C/C(=N/NC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C)/C4=CC=C(C=C4)OC |
Product Overview
(Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide (CAS 303107-30-4), with molecular formula C29H31N5O2S and molecular weight 513.22 g/mol. IUPAC: 2-[[5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]acetamide.
Chemical Property Profile of (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide
Property Insights of (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide
The XLogP value of 5.8729 indicates that (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide. Following Lipinski's Rule of Five, (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide?
The CAS number of (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide is 303107-30-4.
What is the molecular formula of (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide?
The molecular formula of (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide is C29H31N5O2S.
What is the molecular weight of (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide?
The molecular weight of (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide is 513.22 g/mol.
Where can I buy (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide?
You can request a quote for (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-((5-(4-(tert-butyl)phenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-methoxyphenyl)ethylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.