1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone
TL;DR: 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone (CAS 882149-43-1) is a chemical compound with molecular formula C13H12ClN3O3 and molecular weight 293.05673 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone
Also Known As: 1-(3-chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone, 1-(3-chlorophenyl)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethan-1-one
Technical Specifications
| Molecular Formula | C13H12ClN3O3 |
| Molecular Weight | 293.05673 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 80.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.05673 Da |
| Heavy Atoms | 20 |
| Complexity | 388.0 |
| SMILES | CC1=C(C(=NN1CC(=O)C2=CC(=CC=C2)Cl)C)[N+](=O)[O-] |
| InChIKey | GNQVVYNOHZMEPU-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone
Property Insights of 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone
The XLogP value of 3.0 indicates that 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone. Following Lipinski's Rule of Five, 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone?
The CAS number of 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone is 882149-43-1.
What is the molecular formula of 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone?
The molecular formula of 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone is C13H12ClN3O3.
What is the molecular weight of 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone?
The molecular weight of 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone is 293.05673 g/mol.
Where can I buy 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone?
You can request a quote for 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone?
Yes, CoreyChem provides custom synthesis services for 1-(3-Chlorophenyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.