(E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide
TL;DR: (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide (CAS 612827-53-9) is a chemical compound with molecular formula C24H21N5O3S and molecular weight 459.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide, N'-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-2-{[4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide, N-((1E,3E)-4-(2-furyl)-1-azabuta-1,3-dienyl)-2-[4-(4-methoxyphenyl)-5-phenyl(1 ,2,4-triazol-3-ylthio)]acetamide, N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C24H21N5O3S |
|---|---|
| Molecular Weight | 459.14 g/mol |
| LogP | 4.4434 |
| Topological Polar Surface Area | 94.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 459.1365 |
| Heavy Atoms | 33 |
| Complexity | 1233.1174 |
Chemical Identifiers
| CAS Number | 612827-53-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C/C=C/C3=CC=CO3)C4=CC=CC=C4 |
Product Overview
(E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide (CAS 612827-53-9), with molecular formula C24H21N5O3S and molecular weight 459.14 g/mol. IUPAC: N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide
Property Insights of (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide
The XLogP value of 4.4434 indicates that (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.54 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide. Following Lipinski's Rule of Five, (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide?
The CAS number of (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide is 612827-53-9.
What is the molecular formula of (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide?
The molecular formula of (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide is C24H21N5O3S.
What is the molecular weight of (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide?
The molecular weight of (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide is 459.14 g/mol.
Where can I buy (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide?
You can request a quote for (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-((E)-3-(furan-2-yl)allylidene)-2-((4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.