![N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide structure](/static/products/524/52472-98-7.png)
N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide
TL;DR: N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide (CAS 52472-98-7) is a chemical compound with molecular formula C11H8Cl3N3O2 and molecular weight 318.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]acetamide
Also Known As: 3-Propeneamido-1-(2,4,6-trichlorophenyl)-5-pyrazolone, N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide, N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]acetamide, 3-acetamido-1-(2,4,6-trichlorophenyl)-2-pyrazolin-5-one, 1-(2,4,6-trichlorophenyl)-3 -acetylamino-5-oxo-2-pyrazoline
| Molecular Formula | C11H8Cl3N3O2 |
|---|---|
| Molecular Weight | 318.97 g/mol |
| LogP | 2.8331 |
| Topological Polar Surface Area | 61.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.9682 |
| Heavy Atoms | 19 |
| Complexity | 577.8434 |
Chemical Identifiers
| CAS Number | 52472-98-7 |
|---|---|
| SMILES | CC(=O)NC1=NN(C(=O)C1)C2=C(C=C(C=C2Cl)Cl)Cl |
Product Overview
N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide (CAS 52472-98-7), with molecular formula C11H8Cl3N3O2 and molecular weight 318.97 g/mol. IUPAC: N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]acetamide.
Chemical Property Profile of N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide
Property Insights of N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide
The XLogP value of 2.8331 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide. The TPSA of 61.77 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide. Following Lipinski's Rule of Five, N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide has 1 hydrogen bond donor(s) and 3 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-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide?
The CAS number of N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide is 52472-98-7.
What is the molecular formula of N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide?
The molecular formula of N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide is C11H8Cl3N3O2.
What is the molecular weight of N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide?
The molecular weight of N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide is 318.97 g/mol.
Where can I buy N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide?
You can request a quote for N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-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-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.