(Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate
TL;DR: (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate (CAS 524032-96-0) is a chemical compound with molecular formula C26H25N5OS and molecular weight 455.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl] (1Z)-N-(4-methylanilino)-2-oxopropanimidothioate
Also Known As: (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate, (5-phenethyl-4-phenyl-1,2,4-triazol-3-yl) (1Z)-N-(4-methylanilino)-2-oxopropanimidothioate, 4-phenyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl (1Z)-N-(4-methylphenyl)-2-oxopropanehydrazonothioate
| Molecular Formula | C26H25N5OS |
|---|---|
| Molecular Weight | 455.18 g/mol |
| LogP | 5.46762 |
| Topological Polar Surface Area | 72.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 455.17798 |
| Heavy Atoms | 33 |
| Complexity | 1234.9395 |
Chemical Identifiers
| CAS Number | 524032-96-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N/N=C(/C(=O)C)\SC2=NN=C(N2C3=CC=CC=C3)CCC4=CC=CC=C4 |
Product Overview
(Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate (CAS 524032-96-0), with molecular formula C26H25N5OS and molecular weight 455.18 g/mol. IUPAC: [4-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl] (1Z)-N-(4-methylanilino)-2-oxopropanimidothioate.
Chemical Property Profile of (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate
Property Insights of (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate
The XLogP value of 5.46762 indicates that (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.17 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate. Following Lipinski's Rule of Five, (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate 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)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate?
The CAS number of (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate is 524032-96-0.
What is the molecular formula of (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate?
The molecular formula of (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate is C26H25N5OS.
What is the molecular weight of (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate?
The molecular weight of (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate is 455.18 g/mol.
Where can I buy (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate?
You can request a quote for (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl 2-oxo-N'-(p-tolyl)propanehydrazonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.