![1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE structure](/static/products/478/478250-76-9.png)
1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE
TL;DR: 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE (CAS 478250-76-9) is a chemical compound with molecular formula C27H22ClFN8O4 and molecular weight 576.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]-5-phenyltriazole-4-carboxamide
Also Known As: 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE
| Molecular Formula | C27H22ClFN8O4 |
|---|---|
| Molecular Weight | 576.14 g/mol |
| LogP | 4.4336 |
| Topological Polar Surface Area | 155.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 576.1437 |
| Heavy Atoms | 41 |
| Complexity | 1686.7291 |
Chemical Identifiers
| CAS Number | 478250-76-9 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=N/NC(=O)C2=C(N=NN2C3=NON=C3N)C4=CC=CC=C4)OCC5=C(C=CC=C5Cl)F |
Product Overview
1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE (CAS 478250-76-9), with molecular formula C27H22ClFN8O4 and molecular weight 576.14 g/mol. IUPAC: 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl]methylideneamino]-5-phenyltriazole-4-carboxamide.
Chemical Property Profile of 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE
Property Insights of 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE
The XLogP value of 4.4336 indicates that 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 155.57 Ų indicates high polarity, suggesting 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE?
The CAS number of 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE is 478250-76-9.
What is the molecular formula of 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE?
The molecular formula of 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE is C27H22ClFN8O4.
What is the molecular weight of 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE?
The molecular weight of 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE is 576.14 g/mol.
Where can I buy 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE?
You can request a quote for 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-ETHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.