(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide
TL;DR: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide (CAS 487032-14-4) is a chemical compound with molecular formula C20H27N9O5 and molecular weight 473.21 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)-5-(diethylaminomethyl)-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]triazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(diethylaminomethyl)-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]triazole-4-carboxamide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C20H27N9O5 |
|---|---|
| Molecular Weight | 473.21 g/mol |
| LogP | 0.864 |
| Topological Polar Surface Area | 168.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 11 |
| Exact Mass | 473.2135 |
| Heavy Atoms | 34 |
| Complexity | 1153.5087 |
Chemical Identifiers
| CAS Number | 487032-14-4 |
|---|---|
| SMILES | CCN(CC)CC1=C(N=NN1C2=NON=C2N)C(=O)N/N=C/C3=CC(=C(C=C3OC)OC)OC |
Product Overview
(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide (CAS 487032-14-4), with molecular formula C20H27N9O5 and molecular weight 473.21 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(diethylaminomethyl)-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]triazole-4-carboxamide.
Chemical Property Profile of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide
Property Insights of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide
The XLogP value of 0.864 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide. The TPSA of 168.04 Ų indicates high polarity, suggesting (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-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)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide has 2 hydrogen bond donor(s) and 12 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)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide?
The CAS number of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide is 487032-14-4.
What is the molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide is C20H27N9O5.
What is the molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide is 473.21 g/mol.
Where can I buy (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide?
You can request a quote for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-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)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-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)-5-((diethylamino)methyl)-N'-(2,4,5-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.