2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone
TL;DR: 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone (CAS 1431964-65-6) is a chemical compound with molecular formula C9H12ClN5O3 and molecular weight 273.06287 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-chloro-3-nitropyrazol-1-yl)-1-piperazin-1-ylethanone
Also Known As: 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone, 2-(4-Chloro-3-nitro-1h-pyrazol-1-yl)-1-(piperazin-1-yl)ethan-1-one, 2-(4-chloro-3-nitro-pyrazol-1-yl)-1-piperazin-1-yl-ethanone, 1-[(4-chloro-3-nitro-1H-pyrazol-1-yl)acetyl]piperazine, 2-(4-chloro-3-nitropyrazolyl)-1-piperazinylethan-1-one
Technical Specifications
| Molecular Formula | C9H12ClN5O3 |
| Molecular Weight | 273.06287 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 96.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.06287 Da |
| Heavy Atoms | 18 |
| Complexity | 331.0 |
| SMILES | C1CN(CCN1)C(=O)CN2C=C(C(=N2)[N+](=O)[O-])Cl |
| InChIKey | UTWWSSASUSXVAN-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone
Property Insights of 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone. The TPSA of 96.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone. Following Lipinski's Rule of Five, 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone 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
What is the CAS number of 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone?
The CAS number of 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone is 1431964-65-6.
What is the molecular formula of 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone?
The molecular formula of 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone is C9H12ClN5O3.
What is the molecular weight of 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone?
The molecular weight of 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone is 273.06287 g/mol.
Where can I buy 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone?
You can request a quote for 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone?
Yes, CoreyChem provides custom synthesis services for 2-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(piperazin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.