![N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide structure](/static/products/4894/489450-95-5.webp)
N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
TL;DR: N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide (CAS 489450-95-5) is a chemical compound with molecular formula C16H13BrCl2N6O3 and molecular weight 485.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-bromo-1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitropyrazol-1-yl)acetamide
Also Known As: N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide, N-[3-bromo-1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitropyrazol-1-yl)acetamide, N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-{4-chloro-3-nitro-5-methyl-1H-pyrazol-1-yl}acetamide
| Molecular Formula | C16H13BrCl2N6O3 |
|---|---|
| Molecular Weight | 485.96 g/mol |
| LogP | 4.05252 |
| Topological Polar Surface Area | 107.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 485.96097 |
| Heavy Atoms | 28 |
| Complexity | 1047.5796 |
Chemical Identifiers
| CAS Number | 489450-95-5 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NC2=CN(N=C2Br)CC3=CC=C(C=C3)Cl)[N+](=O)[O-])Cl |
Product Overview
N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide (CAS 489450-95-5), with molecular formula C16H13BrCl2N6O3 and molecular weight 485.96 g/mol. IUPAC: N-[3-bromo-1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitropyrazol-1-yl)acetamide.
Chemical Property Profile of N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Property Insights of N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
The XLogP value of 4.05252 indicates that N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.88 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide. Following Lipinski's Rule of Five, N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)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 N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide?
The CAS number of N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide is 489450-95-5.
What is the molecular formula of N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide?
The molecular formula of N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide is C16H13BrCl2N6O3.
What is the molecular weight of N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide?
The molecular weight of N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide is 485.96 g/mol.
Where can I buy N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide?
You can request a quote for N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-bromo-1-(4-chlorobenzyl)-1H-pyrazol-4-yl]-2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.