(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide
TL;DR: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 849923-75-7) is a chemical compound with molecular formula C23H25N9O4 and molecular weight 491.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(4-ethoxy-3-methoxyphenyl)methylideneamino]-5-[(N-methylanilino)methyl]triazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(4-ethoxy-3-methoxyphenyl)methylideneamino]-5-[(N-methylanilino)methyl]triazole-4-carboxamide
| Molecular Formula | C23H25N9O4 |
|---|---|
| Molecular Weight | 491.20 g/mol |
| LogP | 2.0401 |
| Topological Polar Surface Area | 158.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 491.20294 |
| Heavy Atoms | 36 |
| Complexity | 1350.8856 |
Chemical Identifiers
| CAS Number | 849923-75-7 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)/C=N/NC(=O)C2=C(N(N=N2)C3=NON=C3N)CN(C)C4=CC=CC=C4)OC |
Product Overview
(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 849923-75-7), with molecular formula C23H25N9O4 and molecular weight 491.20 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(4-ethoxy-3-methoxyphenyl)methylideneamino]-5-[(N-methylanilino)methyl]triazole-4-carboxamide.
Chemical Property Profile of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide
Property Insights of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide
The XLogP value of 2.0401 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide. The TPSA of 158.81 Ų indicates high polarity, suggesting (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The CAS number of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide is 849923-75-7.
What is the molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide is C23H25N9O4.
What is the molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide is 491.20 g/mol.
Where can I buy (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
You can request a quote for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-ethoxy-3-methoxybenzylidene)-5-((methyl(phenyl)amino)methyl)-1H-1,2,3-triazole-4-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.