(E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide
TL;DR: (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide (CAS 348588-40-9) is a chemical compound with molecular formula C19H18N6O4S and molecular weight 426.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(3-methoxyphenyl)methylideneamino]-2-[[4-methyl-5-(3-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide, N'-[(E)-(3-methoxyphenyl)methylidene]-2-{[4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide, N-[(E)-(3-methoxyphenyl)methylideneamino]-2-[[4-methyl-5-(3-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C19H18N6O4S |
|---|---|
| Molecular Weight | 426.11 g/mol |
| LogP | 2.6413 |
| Topological Polar Surface Area | 124.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 426.11102 |
| Heavy Atoms | 30 |
| Complexity | 1098.1337 |
Chemical Identifiers
| CAS Number | 348588-40-9 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)N/N=C/C2=CC(=CC=C2)OC)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
(E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide (CAS 348588-40-9), with molecular formula C19H18N6O4S and molecular weight 426.11 g/mol. IUPAC: N-[(E)-(3-methoxyphenyl)methylideneamino]-2-[[4-methyl-5-(3-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide
Property Insights of (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide
The XLogP value of 2.6413 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide. The TPSA of 124.54 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide. Following Lipinski's Rule of Five, (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide has 1 hydrogen bond donor(s) and 8 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'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide?
The CAS number of (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide is 348588-40-9.
What is the molecular formula of (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide?
The molecular formula of (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide is C19H18N6O4S.
What is the molecular weight of (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide?
The molecular weight of (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide is 426.11 g/mol.
Where can I buy (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide?
You can request a quote for (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-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'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(3-methoxybenzylidene)-2-((4-methyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.