![N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide structure](/static/products/5128/512816-69-2.webp)
N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide
TL;DR: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide (CAS 512816-69-2) is a chemical compound with molecular formula C17H12ClN5O6 and molecular weight 417.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide
Also Known As: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide, N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitro-1H-pyrazol-1-yl)acetamide, N-{3-(4-chlorophenoxy)-5-nitrophenyl}-2-{4-nitro-1H-pyrazol-1-yl}acetamide
| Molecular Formula | C17H12ClN5O6 |
|---|---|
| Molecular Weight | 417.05 g/mol |
| LogP | 3.7839 |
| Topological Polar Surface Area | 142.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 417.0476 |
| Heavy Atoms | 29 |
| Complexity | 1082.1725 |
Chemical Identifiers
| CAS Number | 512816-69-2 |
|---|---|
| SMILES | C1=CC(=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CN3C=C(C=N3)[N+](=O)[O-])Cl |
Product Overview
N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide (CAS 512816-69-2), with molecular formula C17H12ClN5O6 and molecular weight 417.05 g/mol. IUPAC: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide.
Chemical Property Profile of N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide
Property Insights of N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide
The XLogP value of 3.7839 indicates that N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.43 Ų indicates high polarity, suggesting N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide 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-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide?
The CAS number of N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide is 512816-69-2.
What is the molecular formula of N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide?
The molecular formula of N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide is C17H12ClN5O6.
What is the molecular weight of N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide?
The molecular weight of N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide is 417.05 g/mol.
Where can I buy N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide?
You can request a quote for N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-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-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2-(4-nitropyrazol-1-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.