2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide
TL;DR: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide (CAS 665013-40-1) is a chemical compound with molecular formula C16H12BrN5O3 and molecular weight 401.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide
Also Known As: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide, AN-465/41401147, N-(biphenyl-2-yl)-2-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)acetamide, N-([1,1'-biphenyl]-2-yl)-2-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)acetamide, N-[1,1'-biphenyl]-2-yl-2-{5-bromo-3-nitro-1H-1,2,4-triazol-1-yl}acetamide
| Molecular Formula | C16H12BrN5O3 |
|---|---|
| Molecular Weight | 401.01 g/mol |
| LogP | 3.2545 |
| Topological Polar Surface Area | 102.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.01236 |
| Heavy Atoms | 25 |
| Complexity | 926.5294 |
Chemical Identifiers
| CAS Number | 665013-40-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=CC=C2NC(=O)CN3C(=NC(=N3)[N+](=O)[O-])Br |
Product Overview
2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide (CAS 665013-40-1), with molecular formula C16H12BrN5O3 and molecular weight 401.01 g/mol. IUPAC: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide.
Chemical Property Profile of 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide
Property Insights of 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide
The XLogP value of 3.2545 indicates that 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide. Following Lipinski's Rule of Five, 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide has 1 hydrogen bond donor(s) and 5 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 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide?
The CAS number of 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide is 665013-40-1.
What is the molecular formula of 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide?
The molecular formula of 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide is C16H12BrN5O3.
What is the molecular weight of 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide?
The molecular weight of 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide is 401.01 g/mol.
Where can I buy 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide?
You can request a quote for 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-phenylphenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.