(Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate
TL;DR: (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate (CAS 306756-29-6) is a chemical compound with molecular formula C27H25N5O5S and molecular weight 531.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(Z)-[[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]hydrazinylidene]methyl]-2,6-dimethoxyphenyl] acetate
Also Known As: (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate, [4-[(Z)-[[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]hydrazinylidene]methyl]-2,6-dimethoxyphenyl] acetate
| Molecular Formula | C27H25N5O5S |
|---|---|
| Molecular Weight | 531.16 g/mol |
| LogP | 4.1192 |
| Topological Polar Surface Area | 116.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 531.15765 |
| Heavy Atoms | 38 |
| Complexity | 1416.0061 |
Chemical Identifiers
| CAS Number | 306756-29-6 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1OC)/C=N\NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4)OC |
Product Overview
(Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate (CAS 306756-29-6), with molecular formula C27H25N5O5S and molecular weight 531.16 g/mol. IUPAC: [4-[(Z)-[[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]hydrazinylidene]methyl]-2,6-dimethoxyphenyl] acetate.
Chemical Property Profile of (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate
Property Insights of (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate
The XLogP value of 4.1192 indicates that (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.93 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate. Following Lipinski's Rule of Five, (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate?
The CAS number of (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate is 306756-29-6.
What is the molecular formula of (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate?
The molecular formula of (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate is C27H25N5O5S.
What is the molecular weight of (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate?
The molecular weight of (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate is 531.16 g/mol.
Where can I buy (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate?
You can request a quote for (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-((2-(2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)-2,6-dimethoxyphenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.