![4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide structure](/static/products/5151/515121-06-9.webp)
4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide
TL;DR: 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide (CAS 515121-06-9) is a chemical compound with molecular formula C17H11Cl3N4O3 and molecular weight 423.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[1-[(2,6-dichlorophenyl)methyl]pyrazol-4-yl]-2-nitrobenzamide
Also Known As: 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide, 4-chloro-N-[1-[(2,6-dichlorophenyl)methyl]pyrazol-4-yl]-2-nitrobenzamide, N-{1-[(2,6-dichlorophenyl)methyl]pyrazol-4-yl}(4-chloro-2-nitrophenyl)carboxam ide
| Molecular Formula | C17H11Cl3N4O3 |
|---|---|
| Molecular Weight | 423.99 g/mol |
| LogP | 5.0521 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.9897 |
| Heavy Atoms | 27 |
| Complexity | 1015.7631 |
Chemical Identifiers
| CAS Number | 515121-06-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)CN2C=C(C=N2)NC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])Cl |
Product Overview
4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide (CAS 515121-06-9), with molecular formula C17H11Cl3N4O3 and molecular weight 423.99 g/mol. IUPAC: 4-chloro-N-[1-[(2,6-dichlorophenyl)methyl]pyrazol-4-yl]-2-nitrobenzamide.
Chemical Property Profile of 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide
Property Insights of 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide
The XLogP value of 5.0521 indicates that 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide. Following Lipinski's Rule of Five, 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide?
The CAS number of 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide is 515121-06-9.
What is the molecular formula of 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide?
The molecular formula of 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide is C17H11Cl3N4O3.
What is the molecular weight of 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide?
The molecular weight of 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide is 423.99 g/mol.
Where can I buy 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide?
You can request a quote for 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.