N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide
TL;DR: N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide (CAS 326002-80-6) is a chemical compound with molecular formula C12H11BrN6O4 and molecular weight 382.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide
Also Known As: N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide, N-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide, N'-[(E)-(5-bromo-2-methoxyphenyl)methylidene]-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetohydrazide
| Molecular Formula | C12H11BrN6O4 |
|---|---|
| Molecular Weight | 382.00 g/mol |
| LogP | 1.1077 |
| Topological Polar Surface Area | 124.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.00253 |
| Heavy Atoms | 23 |
| Complexity | 759.7592 |
Chemical Identifiers
| CAS Number | 326002-80-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)/C=N/NC(=O)CN2C=NC(=N2)[N+](=O)[O-] |
Product Overview
N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide (CAS 326002-80-6), with molecular formula C12H11BrN6O4 and molecular weight 382.00 g/mol. IUPAC: N-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide.
Chemical Property Profile of N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide
Property Insights of N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide
The XLogP value of 1.1077 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide. The TPSA of 124.54 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide. Following Lipinski's Rule of Five, N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide has 1 hydrogen bond donor(s) and 7 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 N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide?
The CAS number of N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide is 326002-80-6.
What is the molecular formula of N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide?
The molecular formula of N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide is C12H11BrN6O4.
What is the molecular weight of N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide?
The molecular weight of N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide is 382.00 g/mol.
Where can I buy N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide?
You can request a quote for N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-(5-bromo-2-methoxybenzylidene)-2-{3-nitro-1H-1,2,4-triazol-1-yl}acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.