(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide
TL;DR: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide (CAS 586989-53-9) is a chemical compound with molecular formula C17H20N8O3 and molecular weight 384.17 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)-1-(2-methoxyphenyl)ethylideneamino]-5-propan-2-yltriazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(2-methoxyphenyl)ethylidene]-5-(propan-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C17H20N8O3 |
|---|---|
| Molecular Weight | 384.17 g/mol |
| LogP | 1.5185 |
| Topological Polar Surface Area | 146.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 384.16583 |
| Heavy Atoms | 28 |
| Complexity | 1021.09143 |
Chemical Identifiers
| CAS Number | 586989-53-9 |
|---|---|
| SMILES | CC(C)C1=C(N=NN1C2=NON=C2N)C(=O)N/N=C(\C)/C3=CC=CC=C3OC |
Product Overview
(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide (CAS 586989-53-9), with molecular formula C17H20N8O3 and molecular weight 384.17 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-1-(2-methoxyphenyl)ethylideneamino]-5-propan-2-yltriazole-4-carboxamide.
Chemical Property Profile of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide
Property Insights of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide
The XLogP value of 1.5185 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide. The TPSA of 146.34 Ų indicates high polarity, suggesting (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-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-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide has 2 hydrogen bond donor(s) and 9 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)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide?
The CAS number of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide is 586989-53-9.
What is the molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide is C17H20N8O3.
What is the molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide is 384.17 g/mol.
Where can I buy (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide?
You can request a quote for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-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-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-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-isopropyl-N'-(1-(2-methoxyphenyl)ethylidene)-1H-1,2,3-triazole-4-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.