(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide
TL;DR: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 799770-86-8) is a chemical compound with molecular formula C23H17ClN10O5 and molecular weight 548.11 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-(anilinomethyl)-N-[(E)-[5-(5-chloro-2-nitrophenyl)furan-2-yl]methylideneamino]triazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(anilinomethyl)-N-[(E)-[5-(5-chloro-2-nitrophenyl)furan-2-yl]methylideneamino]triazole-4-carboxamide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[5-(5-chloro-2-nitrophenyl)furan-2-yl]methylidene}-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C23H17ClN10O5 |
|---|---|
| Molecular Weight | 548.11 g/mol |
| LogP | 3.4301 |
| Topological Polar Surface Area | 205.42 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 548.1072 |
| Heavy Atoms | 39 |
| Complexity | 1677.5021 |
Chemical Identifiers
| CAS Number | 799770-86-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)NCC2=C(N=NN2C3=NON=C3N)C(=O)N/N=C/C4=CC=C(O4)C5=C(C=CC(=C5)Cl)[N+](=O)[O-] |
Product Overview
(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 799770-86-8), with molecular formula C23H17ClN10O5 and molecular weight 548.11 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(anilinomethyl)-N-[(E)-[5-(5-chloro-2-nitrophenyl)furan-2-yl]methylideneamino]triazole-4-carboxamide.
Chemical Property Profile of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide
Property Insights of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide
The XLogP value of 3.4301 indicates that (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 205.42 Ų indicates high polarity, suggesting (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)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'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide has 3 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)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The CAS number of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide is 799770-86-8.
What is the molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide is C23H17ClN10O5.
What is the molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide is 548.11 g/mol.
Where can I buy (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)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'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)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'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)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'-((5-(5-chloro-2-nitrophenyl)furan-2-yl)methylene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.