(E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide
TL;DR: (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide (CAS 488716-40-1) is a chemical compound with molecular formula C25H23N5O3S and molecular weight 473.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-ethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]acetamide
Also Known As: (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide, 2-[[4-(4-ethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]acetamide, 2-{[4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio}-N'-[(E,2E)-3-(2-furyl)-2-propenylidene]acetohydrazide
| Molecular Formula | C25H23N5O3S |
|---|---|
| Molecular Weight | 473.15 g/mol |
| LogP | 4.8335 |
| Topological Polar Surface Area | 94.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 473.15216 |
| Heavy Atoms | 34 |
| Complexity | 1249.7202 |
Chemical Identifiers
| CAS Number | 488716-40-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C/C=C/C3=CC=CO3)C4=CC=CC=C4 |
Product Overview
(E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide (CAS 488716-40-1), with molecular formula C25H23N5O3S and molecular weight 473.15 g/mol. IUPAC: 2-[[4-(4-ethoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]acetamide.
Chemical Property Profile of (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide
Property Insights of (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide
The XLogP value of 4.8335 indicates that (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)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)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide. Following Lipinski's Rule of Five, (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)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)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide?
The CAS number of (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide is 488716-40-1.
What is the molecular formula of (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide?
The molecular formula of (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide is C25H23N5O3S.
What is the molecular weight of (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide?
The molecular weight of (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide is 473.15 g/mol.
Where can I buy (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide?
You can request a quote for (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-((4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-((E)-3-(furan-2-yl)allylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.